Program PWSCF v.5.3.0 (svn rev. 11974) starts on 3Jan2017 at 13:53:23 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./BaMnSbF.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S renormalized file Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized file F.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 49 49 14 3523 3523 526 Max 50 50 16 3536 3536 532 Sum 1793 1793 509 127153 127153 19035 bravais-lattice index = 14 lattice parameter (alat) = 8.4350 a.u. unit-cell volume = 1316.0827 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 4 number of electrons = 74.00 number of Kohn-Sham states= 88 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.434981 celldm(2)= 1.000000 celldm(3)= 2.192961 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 2.192961 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 0.456004 ) PseudoPot. # 1 for Ba read from file: /users/gautes/Pseudo/Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3006f3397849ee49953ff32be8e81b23 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1251 points, 11 beta functions with: l(1) = 0 l(2) = 0 l(3) = 0 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 1 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Mn read from file: /users/gautes/Pseudo/Mn.rel-pbe-oncvpsp.UPF MD5 check sum: d838f0974ec4eb0180564ac5264e0bcc Pseudo is Norm-conserving, Zval = 15.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1464 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 PseudoPot. # 3 for Sb read from file: /users/gautes/Pseudo/Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 6eab79124e5b154cf38452ae12125a85 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1243 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 4 for F read from file: /users/gautes/Pseudo/F.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: ce20c52fa94def3fe434d52ed9f7ea44 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1105 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ba 10.00 137.32700 Ba( 1.00) Mn 15.00 54.93800 Mn( 1.00) Sb 5.00 121.76000 Sb( 1.00) F 7.00 18.99840 F( 1.00) 16 Sym. Ops., with inversion, found (12 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 5 180 deg rotation - cart. axis [1,1,0] cryst. s( 5) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cart. axis [1,-1,0] cryst. s( 6) = ( 0 -1 0 ) f =( 0.5000000 ) ( -1 0 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 7 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 -1 0 ) f =( 0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) f =( -0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 9 inversion cryst. s( 9) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 9) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(10) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(10) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 11 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(11) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(11) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 12 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(12) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(12) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 13 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(13) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(13) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(14) = ( 0 1 0 ) f =( 0.5000000 ) ( 1 0 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(14) = ( 0.0000000 1.0000000 -0.0000000 ) f =( 0.5000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) f =( 0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(15) = ( 0.0000000 -1.0000000 -0.0000000 ) f =( 0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) f =( 0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) double point group D_4h(4/mmm) there are 14 classes and 4 irreducible representations the character table: E -E 2C4 -2C4 C2 2C2' 2C2'' i -i 2S4 -2S4 s_h -C2 -2C2' -2C2' -s_h G_6+ 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 2.00 -2.00 1.41 -1.41 0.00 G_7+ 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 2.00 -2.00 -1.41 1.41 0.00 G_6- 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 -2.00 2.00 -1.41 1.41 0.00 G_7- 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 -2.00 2.00 1.41 -1.41 0.00 2s_v 2s_d -2s_v -2s_d G_6+ 0.00 0.00 G_7+ 0.00 0.00 G_6- 0.00 0.00 G_7- 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C4 7 8 90 deg rotation - cart. axis [0,0,-1] -2C4 -7 -8 90 deg rotation - cart. axis [0,0,-1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 2C2'-2C2' 3 -3 4 -4 180 deg rotation - cart. axis [0,1,0] 2C2''-2C2' 5 -5 6 -6 180 deg rotation - cart. axis [1,1,0] i 9 inversion -i -9 inversion E 2S4 15 16 inv. 90 deg rotation - cart. axis [0,0,-1] -2S4 -15 -16 inv. 90 deg rotation - cart. axis [0,0,-1] E s_h -s_h 10 -10 inv. 180 deg rotation - cart. axis [0,0,1] 2s_v-2s_v 11 -11 12 -12 inv. 180 deg rotation - cart. axis [0,1,0] 2s_d-2s_d 13 -13 14 -14 inv. 180 deg rotation - cart. axis [1,1,0] Cartesian axes number of k points= 304 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032895 k( 2) = ( 0.0000000 0.0138889 -0.0000000), wk = 0.0032895 k( 3) = ( 0.0000000 0.0277778 -0.0000000), wk = 0.0032895 k( 4) = ( 0.0000000 0.0416667 -0.0000000), wk = 0.0032895 k( 5) = ( 0.0000000 0.0555556 -0.0000000), wk = 0.0032895 k( 6) = ( 0.0000000 0.0694444 -0.0000000), wk = 0.0032895 k( 7) = ( 0.0000000 0.0833333 -0.0000000), wk = 0.0032895 k( 8) = ( 0.0000000 0.0972222 -0.0000000), wk = 0.0032895 k( 9) = ( 0.0000000 0.1111111 -0.0000000), wk = 0.0032895 k( 10) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0032895 k( 11) = ( 0.0000000 0.1388889 -0.0000000), wk = 0.0032895 k( 12) = ( 0.0000000 0.1527778 -0.0000000), wk = 0.0032895 k( 13) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0032895 k( 14) = ( 0.0000000 0.1805556 -0.0000000), wk = 0.0032895 k( 15) = ( 0.0000000 0.1944444 -0.0000000), wk = 0.0032895 k( 16) = ( 0.0000000 0.2083333 -0.0000000), wk = 0.0032895 k( 17) = ( 0.0000000 0.2222222 -0.0000000), wk = 0.0032895 k( 18) = ( 0.0000000 0.2361111 -0.0000000), wk = 0.0032895 k( 19) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0032895 k( 20) = ( 0.0000000 0.2638889 -0.0000000), wk = 0.0032895 k( 21) = ( 0.0000000 0.2777778 -0.0000000), wk = 0.0032895 k( 22) = ( 0.0000000 0.2916667 -0.0000000), wk = 0.0032895 k( 23) = ( 0.0000000 0.3055556 -0.0000000), wk = 0.0032895 k( 24) = ( 0.0000000 0.3194444 -0.0000000), wk = 0.0032895 k( 25) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0032895 k( 26) = ( 0.0000000 0.3472222 -0.0000000), wk = 0.0032895 k( 27) = ( 0.0000000 0.3611111 -0.0000000), wk = 0.0032895 k( 28) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0032895 k( 29) = ( 0.0000000 0.3888889 -0.0000000), wk = 0.0032895 k( 30) = ( 0.0000000 0.4027778 -0.0000000), wk = 0.0032895 k( 31) = ( 0.0000000 0.4166667 -0.0000000), wk = 0.0032895 k( 32) = ( 0.0000000 0.4305556 -0.0000000), wk = 0.0032895 k( 33) = ( 0.0000000 0.4444444 -0.0000000), wk = 0.0032895 k( 34) = ( 0.0000000 0.4583333 -0.0000000), wk = 0.0032895 k( 35) = ( 0.0000000 0.4722222 -0.0000000), wk = 0.0032895 k( 36) = ( 0.0000000 0.4861111 -0.0000000), wk = 0.0032895 k( 37) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032895 k( 38) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032895 k( 39) = ( 0.0138889 0.5000000 -0.0000000), wk = 0.0032895 k( 40) = ( 0.0277778 0.5000000 -0.0000000), wk = 0.0032895 k( 41) = ( 0.0416667 0.5000000 -0.0000000), wk = 0.0032895 k( 42) = ( 0.0555556 0.5000000 -0.0000000), wk = 0.0032895 k( 43) = ( 0.0694444 0.5000000 -0.0000000), wk = 0.0032895 k( 44) = ( 0.0833333 0.5000000 -0.0000000), wk = 0.0032895 k( 45) = ( 0.0972222 0.5000000 -0.0000000), wk = 0.0032895 k( 46) = ( 0.1111111 0.5000000 -0.0000000), wk = 0.0032895 k( 47) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0032895 k( 48) = ( 0.1388889 0.5000000 -0.0000000), wk = 0.0032895 k( 49) = ( 0.1527778 0.5000000 -0.0000000), wk = 0.0032895 k( 50) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0032895 k( 51) = ( 0.1805556 0.5000000 -0.0000000), wk = 0.0032895 k( 52) = ( 0.1944444 0.5000000 -0.0000000), wk = 0.0032895 k( 53) = ( 0.2083333 0.5000000 -0.0000000), wk = 0.0032895 k( 54) = ( 0.2222222 0.5000000 -0.0000000), wk = 0.0032895 k( 55) = ( 0.2361111 0.5000000 -0.0000000), wk = 0.0032895 k( 56) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0032895 k( 57) = ( 0.2638889 0.5000000 -0.0000000), wk = 0.0032895 k( 58) = ( 0.2777778 0.5000000 -0.0000000), wk = 0.0032895 k( 59) = ( 0.2916667 0.5000000 -0.0000000), wk = 0.0032895 k( 60) = ( 0.3055556 0.5000000 -0.0000000), wk = 0.0032895 k( 61) = ( 0.3194444 0.5000000 -0.0000000), wk = 0.0032895 k( 62) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0032895 k( 63) = ( 0.3472222 0.5000000 -0.0000000), wk = 0.0032895 k( 64) = ( 0.3611111 0.5000000 -0.0000000), wk = 0.0032895 k( 65) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0032895 k( 66) = ( 0.3888889 0.5000000 -0.0000000), wk = 0.0032895 k( 67) = ( 0.4027778 0.5000000 -0.0000000), wk = 0.0032895 k( 68) = ( 0.4166667 0.5000000 -0.0000000), wk = 0.0032895 k( 69) = ( 0.4305556 0.5000000 -0.0000000), wk = 0.0032895 k( 70) = ( 0.4444444 0.5000000 -0.0000000), wk = 0.0032895 k( 71) = ( 0.4583333 0.5000000 -0.0000000), wk = 0.0032895 k( 72) = ( 0.4722222 0.5000000 -0.0000000), wk = 0.0032895 k( 73) = ( 0.4861111 0.5000000 -0.0000000), wk = 0.0032895 k( 74) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032895 k( 75) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032895 k( 76) = ( 0.4900000 0.4900000 -0.0000000), wk = 0.0032895 k( 77) = ( 0.4800000 0.4800000 -0.0000000), wk = 0.0032895 k( 78) = ( 0.4700000 0.4700000 -0.0000000), wk = 0.0032895 k( 79) = ( 0.4600000 0.4600000 -0.0000000), wk = 0.0032895 k( 80) = ( 0.4500000 0.4500000 -0.0000000), wk = 0.0032895 k( 81) = ( 0.4400000 0.4400000 -0.0000000), wk = 0.0032895 k( 82) = ( 0.4300000 0.4300000 -0.0000000), wk = 0.0032895 k( 83) = ( 0.4200000 0.4200000 -0.0000000), wk = 0.0032895 k( 84) = ( 0.4100000 0.4100000 -0.0000000), wk = 0.0032895 k( 85) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0032895 k( 86) = ( 0.3900000 0.3900000 -0.0000000), wk = 0.0032895 k( 87) = ( 0.3800000 0.3800000 -0.0000000), wk = 0.0032895 k( 88) = ( 0.3700000 0.3700000 -0.0000000), wk = 0.0032895 k( 89) = ( 0.3600000 0.3600000 -0.0000000), wk = 0.0032895 k( 90) = ( 0.3500000 0.3500000 -0.0000000), wk = 0.0032895 k( 91) = ( 0.3400000 0.3400000 -0.0000000), wk = 0.0032895 k( 92) = ( 0.3300000 0.3300000 -0.0000000), wk = 0.0032895 k( 93) = ( 0.3200000 0.3200000 -0.0000000), wk = 0.0032895 k( 94) = ( 0.3100000 0.3100000 -0.0000000), wk = 0.0032895 k( 95) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0032895 k( 96) = ( 0.2900000 0.2900000 -0.0000000), wk = 0.0032895 k( 97) = ( 0.2800000 0.2800000 -0.0000000), wk = 0.0032895 k( 98) = ( 0.2700000 0.2700000 -0.0000000), wk = 0.0032895 k( 99) = ( 0.2600000 0.2600000 -0.0000000), wk = 0.0032895 k( 100) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0032895 k( 101) = ( 0.2400000 0.2400000 -0.0000000), wk = 0.0032895 k( 102) = ( 0.2300000 0.2300000 -0.0000000), wk = 0.0032895 k( 103) = ( 0.2200000 0.2200000 -0.0000000), wk = 0.0032895 k( 104) = ( 0.2100000 0.2100000 -0.0000000), wk = 0.0032895 k( 105) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0032895 k( 106) = ( 0.1900000 0.1900000 -0.0000000), wk = 0.0032895 k( 107) = ( 0.1800000 0.1800000 -0.0000000), wk = 0.0032895 k( 108) = ( 0.1700000 0.1700000 -0.0000000), wk = 0.0032895 k( 109) = ( 0.1600000 0.1600000 -0.0000000), wk = 0.0032895 k( 110) = ( 0.1500000 0.1500000 -0.0000000), wk = 0.0032895 k( 111) = ( 0.1400000 0.1400000 -0.0000000), wk = 0.0032895 k( 112) = ( 0.1300000 0.1300000 -0.0000000), wk = 0.0032895 k( 113) = ( 0.1200000 0.1200000 -0.0000000), wk = 0.0032895 k( 114) = ( 0.1100000 0.1100000 -0.0000000), wk = 0.0032895 k( 115) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0032895 k( 116) = ( 0.0900000 0.0900000 -0.0000000), wk = 0.0032895 k( 117) = ( 0.0800000 0.0800000 -0.0000000), wk = 0.0032895 k( 118) = ( 0.0700000 0.0700000 -0.0000000), wk = 0.0032895 k( 119) = ( 0.0600000 0.0600000 -0.0000000), wk = 0.0032895 k( 120) = ( 0.0500000 0.0500000 -0.0000000), wk = 0.0032895 k( 121) = ( 0.0400000 0.0400000 -0.0000000), wk = 0.0032895 k( 122) = ( 0.0300000 0.0300000 -0.0000000), wk = 0.0032895 k( 123) = ( 0.0200000 0.0200000 -0.0000000), wk = 0.0032895 k( 124) = ( 0.0100000 0.0100000 -0.0000000), wk = 0.0032895 k( 125) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032895 k( 126) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032895 k( 127) = ( 0.0000000 0.0000000 0.0134119), wk = 0.0032895 k( 128) = ( 0.0000000 0.0000000 0.0268238), wk = 0.0032895 k( 129) = ( 0.0000000 0.0000000 0.0402357), wk = 0.0032895 k( 130) = ( 0.0000000 0.0000000 0.0536476), wk = 0.0032895 k( 131) = ( 0.0000000 0.0000000 0.0670595), wk = 0.0032895 k( 132) = ( 0.0000000 0.0000000 0.0804714), wk = 0.0032895 k( 133) = ( 0.0000000 0.0000000 0.0938833), wk = 0.0032895 k( 134) = ( 0.0000000 0.0000000 0.1072952), wk = 0.0032895 k( 135) = ( 0.0000000 0.0000000 0.1207071), wk = 0.0032895 k( 136) = ( 0.0000000 0.0000000 0.1341190), wk = 0.0032895 k( 137) = ( 0.0000000 0.0000000 0.1475309), wk = 0.0032895 k( 138) = ( 0.0000000 0.0000000 0.1609428), wk = 0.0032895 k( 139) = ( 0.0000000 0.0000000 0.1743547), wk = 0.0032895 k( 140) = ( 0.0000000 0.0000000 0.1877666), wk = 0.0032895 k( 141) = ( 0.0000000 0.0000000 0.2011785), wk = 0.0032895 k( 142) = ( 0.0000000 0.0000000 0.2145904), wk = 0.0032895 k( 143) = ( 0.0000000 0.0000000 0.2280022), wk = 0.0032895 k( 144) = ( 0.0000000 0.0000000 0.2280022), wk = 0.0032895 k( 145) = ( 0.0000000 0.0138889 0.2280022), wk = 0.0032895 k( 146) = ( 0.0000000 0.0277778 0.2280022), wk = 0.0032895 k( 147) = ( 0.0000000 0.0416667 0.2280022), wk = 0.0032895 k( 148) = ( 0.0000000 0.0555556 0.2280022), wk = 0.0032895 k( 149) = ( 0.0000000 0.0694444 0.2280022), wk = 0.0032895 k( 150) = ( 0.0000000 0.0833333 0.2280022), wk = 0.0032895 k( 151) = ( 0.0000000 0.0972222 0.2280022), wk = 0.0032895 k( 152) = ( 0.0000000 0.1111111 0.2280022), wk = 0.0032895 k( 153) = ( 0.0000000 0.1250000 0.2280022), wk = 0.0032895 k( 154) = ( 0.0000000 0.1388889 0.2280022), wk = 0.0032895 k( 155) = ( 0.0000000 0.1527778 0.2280022), wk = 0.0032895 k( 156) = ( 0.0000000 0.1666667 0.2280022), wk = 0.0032895 k( 157) = ( 0.0000000 0.1805556 0.2280022), wk = 0.0032895 k( 158) = ( 0.0000000 0.1944444 0.2280022), wk = 0.0032895 k( 159) = ( 0.0000000 0.2083333 0.2280022), wk = 0.0032895 k( 160) = ( 0.0000000 0.2222222 0.2280022), wk = 0.0032895 k( 161) = ( 0.0000000 0.2361111 0.2280022), wk = 0.0032895 k( 162) = ( 0.0000000 0.2500000 0.2280022), wk = 0.0032895 k( 163) = ( 0.0000000 0.2638889 0.2280022), wk = 0.0032895 k( 164) = ( 0.0000000 0.2777778 0.2280022), wk = 0.0032895 k( 165) = ( 0.0000000 0.2916667 0.2280022), wk = 0.0032895 k( 166) = ( 0.0000000 0.3055556 0.2280022), wk = 0.0032895 k( 167) = ( 0.0000000 0.3194444 0.2280022), wk = 0.0032895 k( 168) = ( 0.0000000 0.3333333 0.2280022), wk = 0.0032895 k( 169) = ( 0.0000000 0.3472222 0.2280022), wk = 0.0032895 k( 170) = ( 0.0000000 0.3611111 0.2280022), wk = 0.0032895 k( 171) = ( 0.0000000 0.3750000 0.2280022), wk = 0.0032895 k( 172) = ( 0.0000000 0.3888889 0.2280022), wk = 0.0032895 k( 173) = ( 0.0000000 0.4027778 0.2280022), wk = 0.0032895 k( 174) = ( 0.0000000 0.4166667 0.2280022), wk = 0.0032895 k( 175) = ( 0.0000000 0.4305556 0.2280022), wk = 0.0032895 k( 176) = ( 0.0000000 0.4444444 0.2280022), wk = 0.0032895 k( 177) = ( 0.0000000 0.4583333 0.2280022), wk = 0.0032895 k( 178) = ( 0.0000000 0.4722222 0.2280022), wk = 0.0032895 k( 179) = ( 0.0000000 0.4861111 0.2280022), wk = 0.0032895 k( 180) = ( 0.0000000 0.5000000 0.2280022), wk = 0.0032895 k( 181) = ( 0.0000000 0.5000000 0.2280022), wk = 0.0032895 k( 182) = ( 0.0138889 0.5000000 0.2280022), wk = 0.0032895 k( 183) = ( 0.0277778 0.5000000 0.2280022), wk = 0.0032895 k( 184) = ( 0.0416667 0.5000000 0.2280022), wk = 0.0032895 k( 185) = ( 0.0555556 0.5000000 0.2280022), wk = 0.0032895 k( 186) = ( 0.0694444 0.5000000 0.2280022), wk = 0.0032895 k( 187) = ( 0.0833333 0.5000000 0.2280022), wk = 0.0032895 k( 188) = ( 0.0972222 0.5000000 0.2280022), wk = 0.0032895 k( 189) = ( 0.1111111 0.5000000 0.2280022), wk = 0.0032895 k( 190) = ( 0.1250000 0.5000000 0.2280022), wk = 0.0032895 k( 191) = ( 0.1388889 0.5000000 0.2280022), wk = 0.0032895 k( 192) = ( 0.1527778 0.5000000 0.2280022), wk = 0.0032895 k( 193) = ( 0.1666667 0.5000000 0.2280022), wk = 0.0032895 k( 194) = ( 0.1805556 0.5000000 0.2280022), wk = 0.0032895 k( 195) = ( 0.1944444 0.5000000 0.2280022), wk = 0.0032895 k( 196) = ( 0.2083333 0.5000000 0.2280022), wk = 0.0032895 k( 197) = ( 0.2222222 0.5000000 0.2280022), wk = 0.0032895 k( 198) = ( 0.2361111 0.5000000 0.2280022), wk = 0.0032895 k( 199) = ( 0.2500000 0.5000000 0.2280022), wk = 0.0032895 k( 200) = ( 0.2638889 0.5000000 0.2280022), wk = 0.0032895 k( 201) = ( 0.2777778 0.5000000 0.2280022), wk = 0.0032895 k( 202) = ( 0.2916667 0.5000000 0.2280022), wk = 0.0032895 k( 203) = ( 0.3055556 0.5000000 0.2280022), wk = 0.0032895 k( 204) = ( 0.3194444 0.5000000 0.2280022), wk = 0.0032895 k( 205) = ( 0.3333333 0.5000000 0.2280022), wk = 0.0032895 k( 206) = ( 0.3472222 0.5000000 0.2280022), wk = 0.0032895 k( 207) = ( 0.3611111 0.5000000 0.2280022), wk = 0.0032895 k( 208) = ( 0.3750000 0.5000000 0.2280022), wk = 0.0032895 k( 209) = ( 0.3888889 0.5000000 0.2280022), wk = 0.0032895 k( 210) = ( 0.4027778 0.5000000 0.2280022), wk = 0.0032895 k( 211) = ( 0.4166667 0.5000000 0.2280022), wk = 0.0032895 k( 212) = ( 0.4305556 0.5000000 0.2280022), wk = 0.0032895 k( 213) = ( 0.4444444 0.5000000 0.2280022), wk = 0.0032895 k( 214) = ( 0.4583333 0.5000000 0.2280022), wk = 0.0032895 k( 215) = ( 0.4722222 0.5000000 0.2280022), wk = 0.0032895 k( 216) = ( 0.4861111 0.5000000 0.2280022), wk = 0.0032895 k( 217) = ( 0.5000000 0.5000000 0.2280022), wk = 0.0032895 k( 218) = ( 0.5000000 0.5000000 0.2280022), wk = 0.0032895 k( 219) = ( 0.4900000 0.4900000 0.2280022), wk = 0.0032895 k( 220) = ( 0.4800000 0.4800000 0.2280022), wk = 0.0032895 k( 221) = ( 0.4700000 0.4700000 0.2280022), wk = 0.0032895 k( 222) = ( 0.4600000 0.4600000 0.2280022), wk = 0.0032895 k( 223) = ( 0.4500000 0.4500000 0.2280022), wk = 0.0032895 k( 224) = ( 0.4400000 0.4400000 0.2280022), wk = 0.0032895 k( 225) = ( 0.4300000 0.4300000 0.2280022), wk = 0.0032895 k( 226) = ( 0.4200000 0.4200000 0.2280022), wk = 0.0032895 k( 227) = ( 0.4100000 0.4100000 0.2280022), wk = 0.0032895 k( 228) = ( 0.4000000 0.4000000 0.2280022), wk = 0.0032895 k( 229) = ( 0.3900000 0.3900000 0.2280022), wk = 0.0032895 k( 230) = ( 0.3800000 0.3800000 0.2280022), wk = 0.0032895 k( 231) = ( 0.3700000 0.3700000 0.2280022), wk = 0.0032895 k( 232) = ( 0.3600000 0.3600000 0.2280022), wk = 0.0032895 k( 233) = ( 0.3500000 0.3500000 0.2280022), wk = 0.0032895 k( 234) = ( 0.3400000 0.3400000 0.2280022), wk = 0.0032895 k( 235) = ( 0.3300000 0.3300000 0.2280022), wk = 0.0032895 k( 236) = ( 0.3200000 0.3200000 0.2280022), wk = 0.0032895 k( 237) = ( 0.3100000 0.3100000 0.2280022), wk = 0.0032895 k( 238) = ( 0.3000000 0.3000000 0.2280022), wk = 0.0032895 k( 239) = ( 0.2900000 0.2900000 0.2280022), wk = 0.0032895 k( 240) = ( 0.2800000 0.2800000 0.2280022), wk = 0.0032895 k( 241) = ( 0.2700000 0.2700000 0.2280022), wk = 0.0032895 k( 242) = ( 0.2600000 0.2600000 0.2280022), wk = 0.0032895 k( 243) = ( 0.2500000 0.2500000 0.2280022), wk = 0.0032895 k( 244) = ( 0.2400000 0.2400000 0.2280022), wk = 0.0032895 k( 245) = ( 0.2300000 0.2300000 0.2280022), wk = 0.0032895 k( 246) = ( 0.2200000 0.2200000 0.2280022), wk = 0.0032895 k( 247) = ( 0.2100000 0.2100000 0.2280022), wk = 0.0032895 k( 248) = ( 0.2000000 0.2000000 0.2280022), wk = 0.0032895 k( 249) = ( 0.1900000 0.1900000 0.2280022), wk = 0.0032895 k( 250) = ( 0.1800000 0.1800000 0.2280022), wk = 0.0032895 k( 251) = ( 0.1700000 0.1700000 0.2280022), wk = 0.0032895 k( 252) = ( 0.1600000 0.1600000 0.2280022), wk = 0.0032895 k( 253) = ( 0.1500000 0.1500000 0.2280022), wk = 0.0032895 k( 254) = ( 0.1400000 0.1400000 0.2280022), wk = 0.0032895 k( 255) = ( 0.1300000 0.1300000 0.2280022), wk = 0.0032895 k( 256) = ( 0.1200000 0.1200000 0.2280022), wk = 0.0032895 k( 257) = ( 0.1100000 0.1100000 0.2280022), wk = 0.0032895 k( 258) = ( 0.1000000 0.1000000 0.2280022), wk = 0.0032895 k( 259) = ( 0.0900000 0.0900000 0.2280022), wk = 0.0032895 k( 260) = ( 0.0800000 0.0800000 0.2280022), wk = 0.0032895 k( 261) = ( 0.0700000 0.0700000 0.2280022), wk = 0.0032895 k( 262) = ( 0.0600000 0.0600000 0.2280022), wk = 0.0032895 k( 263) = ( 0.0500000 0.0500000 0.2280022), wk = 0.0032895 k( 264) = ( 0.0400000 0.0400000 0.2280022), wk = 0.0032895 k( 265) = ( 0.0300000 0.0300000 0.2280022), wk = 0.0032895 k( 266) = ( 0.0200000 0.0200000 0.2280022), wk = 0.0032895 k( 267) = ( 0.0100000 0.0100000 0.2280022), wk = 0.0032895 k( 268) = ( 0.0000000 0.0000000 0.2280022), wk = 0.0032895 k( 269) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032895 k( 270) = ( 0.0000000 0.5000000 0.0134119), wk = 0.0032895 k( 271) = ( 0.0000000 0.5000000 0.0268238), wk = 0.0032895 k( 272) = ( 0.0000000 0.5000000 0.0402357), wk = 0.0032895 k( 273) = ( 0.0000000 0.5000000 0.0536476), wk = 0.0032895 k( 274) = ( 0.0000000 0.5000000 0.0670595), wk = 0.0032895 k( 275) = ( 0.0000000 0.5000000 0.0804714), wk = 0.0032895 k( 276) = ( 0.0000000 0.5000000 0.0938833), wk = 0.0032895 k( 277) = ( 0.0000000 0.5000000 0.1072952), wk = 0.0032895 k( 278) = ( 0.0000000 0.5000000 0.1207071), wk = 0.0032895 k( 279) = ( 0.0000000 0.5000000 0.1341190), wk = 0.0032895 k( 280) = ( 0.0000000 0.5000000 0.1475309), wk = 0.0032895 k( 281) = ( 0.0000000 0.5000000 0.1609428), wk = 0.0032895 k( 282) = ( 0.0000000 0.5000000 0.1743547), wk = 0.0032895 k( 283) = ( 0.0000000 0.5000000 0.1877666), wk = 0.0032895 k( 284) = ( 0.0000000 0.5000000 0.2011785), wk = 0.0032895 k( 285) = ( 0.0000000 0.5000000 0.2145904), wk = 0.0032895 k( 286) = ( 0.0000000 0.5000000 0.2280022), wk = 0.0032895 k( 287) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032895 k( 288) = ( 0.5000000 0.5000000 0.0134119), wk = 0.0032895 k( 289) = ( 0.5000000 0.5000000 0.0268238), wk = 0.0032895 k( 290) = ( 0.5000000 0.5000000 0.0402357), wk = 0.0032895 k( 291) = ( 0.5000000 0.5000000 0.0536476), wk = 0.0032895 k( 292) = ( 0.5000000 0.5000000 0.0670595), wk = 0.0032895 k( 293) = ( 0.5000000 0.5000000 0.0804714), wk = 0.0032895 k( 294) = ( 0.5000000 0.5000000 0.0938833), wk = 0.0032895 k( 295) = ( 0.5000000 0.5000000 0.1072952), wk = 0.0032895 k( 296) = ( 0.5000000 0.5000000 0.1207071), wk = 0.0032895 k( 297) = ( 0.5000000 0.5000000 0.1341190), wk = 0.0032895 k( 298) = ( 0.5000000 0.5000000 0.1475309), wk = 0.0032895 k( 299) = ( 0.5000000 0.5000000 0.1609428), wk = 0.0032895 k( 300) = ( 0.5000000 0.5000000 0.1743547), wk = 0.0032895 k( 301) = ( 0.5000000 0.5000000 0.1877666), wk = 0.0032895 k( 302) = ( 0.5000000 0.5000000 0.2011785), wk = 0.0032895 k( 303) = ( 0.5000000 0.5000000 0.2145904), wk = 0.0032895 k( 304) = ( 0.5000000 0.5000000 0.2280022), wk = 0.0032895 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032895 k( 2) = ( 0.0000000 0.0138889 0.0000000), wk = 0.0032895 k( 3) = ( 0.0000000 0.0277778 0.0000000), wk = 0.0032895 k( 4) = ( 0.0000000 0.0416667 -0.0000000), wk = 0.0032895 k( 5) = ( 0.0000000 0.0555556 0.0000000), wk = 0.0032895 k( 6) = ( 0.0000000 0.0694444 -0.0000000), wk = 0.0032895 k( 7) = ( 0.0000000 0.0833333 0.0000000), wk = 0.0032895 k( 8) = ( 0.0000000 0.0972222 -0.0000000), wk = 0.0032895 k( 9) = ( 0.0000000 0.1111111 -0.0000000), wk = 0.0032895 k( 10) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0032895 k( 11) = ( 0.0000000 0.1388889 -0.0000000), wk = 0.0032895 k( 12) = ( 0.0000000 0.1527778 -0.0000000), wk = 0.0032895 k( 13) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0032895 k( 14) = ( 0.0000000 0.1805556 -0.0000000), wk = 0.0032895 k( 15) = ( 0.0000000 0.1944444 -0.0000000), wk = 0.0032895 k( 16) = ( 0.0000000 0.2083333 -0.0000000), wk = 0.0032895 k( 17) = ( 0.0000000 0.2222222 -0.0000000), wk = 0.0032895 k( 18) = ( 0.0000000 0.2361111 -0.0000000), wk = 0.0032895 k( 19) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0032895 k( 20) = ( 0.0000000 0.2638889 0.0000000), wk = 0.0032895 k( 21) = ( 0.0000000 0.2777778 -0.0000000), wk = 0.0032895 k( 22) = ( 0.0000000 0.2916667 -0.0000000), wk = 0.0032895 k( 23) = ( 0.0000000 0.3055556 -0.0000000), wk = 0.0032895 k( 24) = ( 0.0000000 0.3194444 0.0000000), wk = 0.0032895 k( 25) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0032895 k( 26) = ( 0.0000000 0.3472222 0.0000000), wk = 0.0032895 k( 27) = ( 0.0000000 0.3611111 0.0000000), wk = 0.0032895 k( 28) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0032895 k( 29) = ( 0.0000000 0.3888889 -0.0000000), wk = 0.0032895 k( 30) = ( 0.0000000 0.4027778 -0.0000000), wk = 0.0032895 k( 31) = ( 0.0000000 0.4166667 -0.0000000), wk = 0.0032895 k( 32) = ( 0.0000000 0.4305556 0.0000000), wk = 0.0032895 k( 33) = ( 0.0000000 0.4444444 -0.0000000), wk = 0.0032895 k( 34) = ( 0.0000000 0.4583333 -0.0000000), wk = 0.0032895 k( 35) = ( 0.0000000 0.4722222 -0.0000000), wk = 0.0032895 k( 36) = ( 0.0000000 0.4861111 -0.0000000), wk = 0.0032895 k( 37) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032895 k( 38) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032895 k( 39) = ( 0.0138889 0.5000000 0.0000000), wk = 0.0032895 k( 40) = ( 0.0277778 0.5000000 0.0000000), wk = 0.0032895 k( 41) = ( 0.0416667 0.5000000 0.0000000), wk = 0.0032895 k( 42) = ( 0.0555556 0.5000000 -0.0000000), wk = 0.0032895 k( 43) = ( 0.0694444 0.5000000 0.0000000), wk = 0.0032895 k( 44) = ( 0.0833333 0.5000000 -0.0000000), wk = 0.0032895 k( 45) = ( 0.0972222 0.5000000 0.0000000), wk = 0.0032895 k( 46) = ( 0.1111111 0.5000000 0.0000000), wk = 0.0032895 k( 47) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0032895 k( 48) = ( 0.1388889 0.5000000 0.0000000), wk = 0.0032895 k( 49) = ( 0.1527778 0.5000000 -0.0000000), wk = 0.0032895 k( 50) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0032895 k( 51) = ( 0.1805556 0.5000000 0.0000000), wk = 0.0032895 k( 52) = ( 0.1944444 0.5000000 0.0000000), wk = 0.0032895 k( 53) = ( 0.2083333 0.5000000 0.0000000), wk = 0.0032895 k( 54) = ( 0.2222222 0.5000000 -0.0000000), wk = 0.0032895 k( 55) = ( 0.2361111 0.5000000 0.0000000), wk = 0.0032895 k( 56) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0032895 k( 57) = ( 0.2638889 0.5000000 -0.0000000), wk = 0.0032895 k( 58) = ( 0.2777778 0.5000000 -0.0000000), wk = 0.0032895 k( 59) = ( 0.2916667 0.5000000 -0.0000000), wk = 0.0032895 k( 60) = ( 0.3055556 0.5000000 -0.0000000), wk = 0.0032895 k( 61) = ( 0.3194444 0.5000000 -0.0000000), wk = 0.0032895 k( 62) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0032895 k( 63) = ( 0.3472222 0.5000000 -0.0000000), wk = 0.0032895 k( 64) = ( 0.3611111 0.5000000 -0.0000000), wk = 0.0032895 k( 65) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0032895 k( 66) = ( 0.3888889 0.5000000 -0.0000000), wk = 0.0032895 k( 67) = ( 0.4027778 0.5000000 -0.0000000), wk = 0.0032895 k( 68) = ( 0.4166667 0.5000000 -0.0000000), wk = 0.0032895 k( 69) = ( 0.4305556 0.5000000 -0.0000000), wk = 0.0032895 k( 70) = ( 0.4444444 0.5000000 -0.0000000), wk = 0.0032895 k( 71) = ( 0.4583333 0.5000000 0.0000000), wk = 0.0032895 k( 72) = ( 0.4722222 0.5000000 0.0000000), wk = 0.0032895 k( 73) = ( 0.4861111 0.5000000 -0.0000000), wk = 0.0032895 k( 74) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0032895 k( 75) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0032895 k( 76) = ( 0.4900000 0.4900000 -0.0000000), wk = 0.0032895 k( 77) = ( 0.4800000 0.4800000 -0.0000000), wk = 0.0032895 k( 78) = ( 0.4700000 0.4700000 0.0000000), wk = 0.0032895 k( 79) = ( 0.4600000 0.4600000 -0.0000000), wk = 0.0032895 k( 80) = ( 0.4500000 0.4500000 -0.0000000), wk = 0.0032895 k( 81) = ( 0.4400000 0.4400000 -0.0000000), wk = 0.0032895 k( 82) = ( 0.4300000 0.4300000 -0.0000000), wk = 0.0032895 k( 83) = ( 0.4200000 0.4200000 -0.0000000), wk = 0.0032895 k( 84) = ( 0.4100000 0.4100000 -0.0000000), wk = 0.0032895 k( 85) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0032895 k( 86) = ( 0.3900000 0.3900000 -0.0000000), wk = 0.0032895 k( 87) = ( 0.3800000 0.3800000 -0.0000000), wk = 0.0032895 k( 88) = ( 0.3700000 0.3700000 0.0000000), wk = 0.0032895 k( 89) = ( 0.3600000 0.3600000 -0.0000000), wk = 0.0032895 k( 90) = ( 0.3500000 0.3500000 0.0000000), wk = 0.0032895 k( 91) = ( 0.3400000 0.3400000 -0.0000000), wk = 0.0032895 k( 92) = ( 0.3300000 0.3300000 -0.0000000), wk = 0.0032895 k( 93) = ( 0.3200000 0.3200000 -0.0000000), wk = 0.0032895 k( 94) = ( 0.3100000 0.3100000 -0.0000000), wk = 0.0032895 k( 95) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0032895 k( 96) = ( 0.2900000 0.2900000 0.0000000), wk = 0.0032895 k( 97) = ( 0.2800000 0.2800000 -0.0000000), wk = 0.0032895 k( 98) = ( 0.2700000 0.2700000 0.0000000), wk = 0.0032895 k( 99) = ( 0.2600000 0.2600000 0.0000000), wk = 0.0032895 k( 100) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0032895 k( 101) = ( 0.2400000 0.2400000 -0.0000000), wk = 0.0032895 k( 102) = ( 0.2300000 0.2300000 -0.0000000), wk = 0.0032895 k( 103) = ( 0.2200000 0.2200000 -0.0000000), wk = 0.0032895 k( 104) = ( 0.2100000 0.2100000 -0.0000000), wk = 0.0032895 k( 105) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0032895 k( 106) = ( 0.1900000 0.1900000 -0.0000000), wk = 0.0032895 k( 107) = ( 0.1800000 0.1800000 -0.0000000), wk = 0.0032895 k( 108) = ( 0.1700000 0.1700000 -0.0000000), wk = 0.0032895 k( 109) = ( 0.1600000 0.1600000 -0.0000000), wk = 0.0032895 k( 110) = ( 0.1500000 0.1500000 -0.0000000), wk = 0.0032895 k( 111) = ( 0.1400000 0.1400000 -0.0000000), wk = 0.0032895 k( 112) = ( 0.1300000 0.1300000 0.0000000), wk = 0.0032895 k( 113) = ( 0.1200000 0.1200000 -0.0000000), wk = 0.0032895 k( 114) = ( 0.1100000 0.1100000 -0.0000000), wk = 0.0032895 k( 115) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0032895 k( 116) = ( 0.0900000 0.0900000 -0.0000000), wk = 0.0032895 k( 117) = ( 0.0800000 0.0800000 -0.0000000), wk = 0.0032895 k( 118) = ( 0.0700000 0.0700000 -0.0000000), wk = 0.0032895 k( 119) = ( 0.0600000 0.0600000 -0.0000000), wk = 0.0032895 k( 120) = ( 0.0500000 0.0500000 -0.0000000), wk = 0.0032895 k( 121) = ( 0.0400000 0.0400000 -0.0000000), wk = 0.0032895 k( 122) = ( 0.0300000 0.0300000 -0.0000000), wk = 0.0032895 k( 123) = ( 0.0200000 0.0200000 -0.0000000), wk = 0.0032895 k( 124) = ( 0.0100000 0.0100000 -0.0000000), wk = 0.0032895 k( 125) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032895 k( 126) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032895 k( 127) = ( 0.0000000 0.0000000 0.0294118), wk = 0.0032895 k( 128) = ( 0.0000000 0.0000000 0.0588235), wk = 0.0032895 k( 129) = ( 0.0000000 0.0000000 0.0882353), wk = 0.0032895 k( 130) = ( 0.0000000 0.0000000 0.1176471), wk = 0.0032895 k( 131) = ( 0.0000000 0.0000000 0.1470588), wk = 0.0032895 k( 132) = ( 0.0000000 0.0000000 0.1764706), wk = 0.0032895 k( 133) = ( 0.0000000 0.0000000 0.2058824), wk = 0.0032895 k( 134) = ( 0.0000000 0.0000000 0.2352941), wk = 0.0032895 k( 135) = ( 0.0000000 0.0000000 0.2647059), wk = 0.0032895 k( 136) = ( 0.0000000 0.0000000 0.2941177), wk = 0.0032895 k( 137) = ( 0.0000000 0.0000000 0.3235294), wk = 0.0032895 k( 138) = ( 0.0000000 0.0000000 0.3529412), wk = 0.0032895 k( 139) = ( 0.0000000 0.0000000 0.3823529), wk = 0.0032895 k( 140) = ( 0.0000000 0.0000000 0.4117647), wk = 0.0032895 k( 141) = ( 0.0000000 0.0000000 0.4411765), wk = 0.0032895 k( 142) = ( 0.0000000 0.0000000 0.4705882), wk = 0.0032895 k( 143) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032895 k( 144) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032895 k( 145) = ( 0.0000000 0.0138889 0.5000000), wk = 0.0032895 k( 146) = ( 0.0000000 0.0277778 0.5000000), wk = 0.0032895 k( 147) = ( 0.0000000 0.0416667 0.5000000), wk = 0.0032895 k( 148) = ( 0.0000000 0.0555556 0.5000000), wk = 0.0032895 k( 149) = ( 0.0000000 0.0694444 0.5000000), wk = 0.0032895 k( 150) = ( 0.0000000 0.0833333 0.5000000), wk = 0.0032895 k( 151) = ( 0.0000000 0.0972222 0.5000000), wk = 0.0032895 k( 152) = ( 0.0000000 0.1111111 0.5000000), wk = 0.0032895 k( 153) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0032895 k( 154) = ( 0.0000000 0.1388889 0.5000000), wk = 0.0032895 k( 155) = ( 0.0000000 0.1527778 0.5000000), wk = 0.0032895 k( 156) = ( 0.0000000 0.1666667 0.5000000), wk = 0.0032895 k( 157) = ( 0.0000000 0.1805556 0.5000000), wk = 0.0032895 k( 158) = ( 0.0000000 0.1944444 0.5000000), wk = 0.0032895 k( 159) = ( 0.0000000 0.2083333 0.5000000), wk = 0.0032895 k( 160) = ( 0.0000000 0.2222222 0.5000000), wk = 0.0032895 k( 161) = ( 0.0000000 0.2361111 0.5000000), wk = 0.0032895 k( 162) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0032895 k( 163) = ( 0.0000000 0.2638889 0.5000000), wk = 0.0032895 k( 164) = ( 0.0000000 0.2777778 0.5000000), wk = 0.0032895 k( 165) = ( 0.0000000 0.2916667 0.5000000), wk = 0.0032895 k( 166) = ( 0.0000000 0.3055556 0.5000000), wk = 0.0032895 k( 167) = ( 0.0000000 0.3194444 0.5000000), wk = 0.0032895 k( 168) = ( 0.0000000 0.3333333 0.5000000), wk = 0.0032895 k( 169) = ( 0.0000000 0.3472222 0.5000000), wk = 0.0032895 k( 170) = ( 0.0000000 0.3611111 0.5000000), wk = 0.0032895 k( 171) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0032895 k( 172) = ( 0.0000000 0.3888889 0.5000000), wk = 0.0032895 k( 173) = ( 0.0000000 0.4027778 0.5000000), wk = 0.0032895 k( 174) = ( 0.0000000 0.4166667 0.5000000), wk = 0.0032895 k( 175) = ( 0.0000000 0.4305556 0.5000000), wk = 0.0032895 k( 176) = ( 0.0000000 0.4444444 0.5000000), wk = 0.0032895 k( 177) = ( 0.0000000 0.4583333 0.5000000), wk = 0.0032895 k( 178) = ( 0.0000000 0.4722222 0.5000000), wk = 0.0032895 k( 179) = ( 0.0000000 0.4861111 0.5000000), wk = 0.0032895 k( 180) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032895 k( 181) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032895 k( 182) = ( 0.0138889 0.5000000 0.5000000), wk = 0.0032895 k( 183) = ( 0.0277778 0.5000000 0.5000000), wk = 0.0032895 k( 184) = ( 0.0416667 0.5000000 0.5000000), wk = 0.0032895 k( 185) = ( 0.0555556 0.5000000 0.5000000), wk = 0.0032895 k( 186) = ( 0.0694444 0.5000000 0.5000000), wk = 0.0032895 k( 187) = ( 0.0833333 0.5000000 0.5000000), wk = 0.0032895 k( 188) = ( 0.0972222 0.5000000 0.5000000), wk = 0.0032895 k( 189) = ( 0.1111111 0.5000000 0.5000000), wk = 0.0032895 k( 190) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0032895 k( 191) = ( 0.1388889 0.5000000 0.5000000), wk = 0.0032895 k( 192) = ( 0.1527778 0.5000000 0.5000000), wk = 0.0032895 k( 193) = ( 0.1666667 0.5000000 0.5000000), wk = 0.0032895 k( 194) = ( 0.1805556 0.5000000 0.5000000), wk = 0.0032895 k( 195) = ( 0.1944444 0.5000000 0.5000000), wk = 0.0032895 k( 196) = ( 0.2083333 0.5000000 0.5000000), wk = 0.0032895 k( 197) = ( 0.2222222 0.5000000 0.5000000), wk = 0.0032895 k( 198) = ( 0.2361111 0.5000000 0.5000000), wk = 0.0032895 k( 199) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0032895 k( 200) = ( 0.2638889 0.5000000 0.5000000), wk = 0.0032895 k( 201) = ( 0.2777778 0.5000000 0.5000000), wk = 0.0032895 k( 202) = ( 0.2916667 0.5000000 0.5000000), wk = 0.0032895 k( 203) = ( 0.3055556 0.5000000 0.5000000), wk = 0.0032895 k( 204) = ( 0.3194444 0.5000000 0.5000000), wk = 0.0032895 k( 205) = ( 0.3333333 0.5000000 0.5000000), wk = 0.0032895 k( 206) = ( 0.3472222 0.5000000 0.5000000), wk = 0.0032895 k( 207) = ( 0.3611111 0.5000000 0.5000000), wk = 0.0032895 k( 208) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0032895 k( 209) = ( 0.3888889 0.5000000 0.5000000), wk = 0.0032895 k( 210) = ( 0.4027778 0.5000000 0.5000000), wk = 0.0032895 k( 211) = ( 0.4166667 0.5000000 0.5000000), wk = 0.0032895 k( 212) = ( 0.4305556 0.5000000 0.5000000), wk = 0.0032895 k( 213) = ( 0.4444444 0.5000000 0.5000000), wk = 0.0032895 k( 214) = ( 0.4583333 0.5000000 0.5000000), wk = 0.0032895 k( 215) = ( 0.4722222 0.5000000 0.5000000), wk = 0.0032895 k( 216) = ( 0.4861111 0.5000000 0.5000000), wk = 0.0032895 k( 217) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032895 k( 218) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032895 k( 219) = ( 0.4900000 0.4900000 0.5000000), wk = 0.0032895 k( 220) = ( 0.4800000 0.4800000 0.5000000), wk = 0.0032895 k( 221) = ( 0.4700000 0.4700000 0.5000000), wk = 0.0032895 k( 222) = ( 0.4600000 0.4600000 0.5000000), wk = 0.0032895 k( 223) = ( 0.4500000 0.4500000 0.5000000), wk = 0.0032895 k( 224) = ( 0.4400000 0.4400000 0.5000000), wk = 0.0032895 k( 225) = ( 0.4300000 0.4300000 0.5000000), wk = 0.0032895 k( 226) = ( 0.4200000 0.4200000 0.5000000), wk = 0.0032895 k( 227) = ( 0.4100000 0.4100000 0.5000000), wk = 0.0032895 k( 228) = ( 0.4000000 0.4000000 0.5000000), wk = 0.0032895 k( 229) = ( 0.3900000 0.3900000 0.5000000), wk = 0.0032895 k( 230) = ( 0.3800000 0.3800000 0.5000000), wk = 0.0032895 k( 231) = ( 0.3700000 0.3700000 0.5000000), wk = 0.0032895 k( 232) = ( 0.3600000 0.3600000 0.5000000), wk = 0.0032895 k( 233) = ( 0.3500000 0.3500000 0.5000000), wk = 0.0032895 k( 234) = ( 0.3400000 0.3400000 0.5000000), wk = 0.0032895 k( 235) = ( 0.3300000 0.3300000 0.5000000), wk = 0.0032895 k( 236) = ( 0.3200000 0.3200000 0.5000000), wk = 0.0032895 k( 237) = ( 0.3100000 0.3100000 0.5000000), wk = 0.0032895 k( 238) = ( 0.3000000 0.3000000 0.5000000), wk = 0.0032895 k( 239) = ( 0.2900000 0.2900000 0.5000000), wk = 0.0032895 k( 240) = ( 0.2800000 0.2800000 0.5000000), wk = 0.0032895 k( 241) = ( 0.2700000 0.2700000 0.5000000), wk = 0.0032895 k( 242) = ( 0.2600000 0.2600000 0.5000000), wk = 0.0032895 k( 243) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0032895 k( 244) = ( 0.2400000 0.2400000 0.5000000), wk = 0.0032895 k( 245) = ( 0.2300000 0.2300000 0.5000000), wk = 0.0032895 k( 246) = ( 0.2200000 0.2200000 0.5000000), wk = 0.0032895 k( 247) = ( 0.2100000 0.2100000 0.5000000), wk = 0.0032895 k( 248) = ( 0.2000000 0.2000000 0.5000000), wk = 0.0032895 k( 249) = ( 0.1900000 0.1900000 0.5000000), wk = 0.0032895 k( 250) = ( 0.1800000 0.1800000 0.5000000), wk = 0.0032895 k( 251) = ( 0.1700000 0.1700000 0.5000000), wk = 0.0032895 k( 252) = ( 0.1600000 0.1600000 0.5000000), wk = 0.0032895 k( 253) = ( 0.1500000 0.1500000 0.5000000), wk = 0.0032895 k( 254) = ( 0.1400000 0.1400000 0.5000000), wk = 0.0032895 k( 255) = ( 0.1300000 0.1300000 0.5000000), wk = 0.0032895 k( 256) = ( 0.1200000 0.1200000 0.5000000), wk = 0.0032895 k( 257) = ( 0.1100000 0.1100000 0.5000000), wk = 0.0032895 k( 258) = ( 0.1000000 0.1000000 0.5000000), wk = 0.0032895 k( 259) = ( 0.0900000 0.0900000 0.5000000), wk = 0.0032895 k( 260) = ( 0.0800000 0.0800000 0.5000000), wk = 0.0032895 k( 261) = ( 0.0700000 0.0700000 0.5000000), wk = 0.0032895 k( 262) = ( 0.0600000 0.0600000 0.5000000), wk = 0.0032895 k( 263) = ( 0.0500000 0.0500000 0.5000000), wk = 0.0032895 k( 264) = ( 0.0400000 0.0400000 0.5000000), wk = 0.0032895 k( 265) = ( 0.0300000 0.0300000 0.5000000), wk = 0.0032895 k( 266) = ( 0.0200000 0.0200000 0.5000000), wk = 0.0032895 k( 267) = ( 0.0100000 0.0100000 0.5000000), wk = 0.0032895 k( 268) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032895 k( 269) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032895 k( 270) = ( 0.0000000 0.5000000 0.0294118), wk = 0.0032895 k( 271) = ( 0.0000000 0.5000000 0.0588235), wk = 0.0032895 k( 272) = ( 0.0000000 0.5000000 0.0882353), wk = 0.0032895 k( 273) = ( 0.0000000 0.5000000 0.1176471), wk = 0.0032895 k( 274) = ( 0.0000000 0.5000000 0.1470588), wk = 0.0032895 k( 275) = ( 0.0000000 0.5000000 0.1764706), wk = 0.0032895 k( 276) = ( 0.0000000 0.5000000 0.2058823), wk = 0.0032895 k( 277) = ( 0.0000000 0.5000000 0.2352941), wk = 0.0032895 k( 278) = ( 0.0000000 0.5000000 0.2647059), wk = 0.0032895 k( 279) = ( 0.0000000 0.5000000 0.2941177), wk = 0.0032895 k( 280) = ( 0.0000000 0.5000000 0.3235294), wk = 0.0032895 k( 281) = ( 0.0000000 0.5000000 0.3529412), wk = 0.0032895 k( 282) = ( 0.0000000 0.5000000 0.3823529), wk = 0.0032895 k( 283) = ( 0.0000000 0.5000000 0.4117647), wk = 0.0032895 k( 284) = ( 0.0000000 0.5000000 0.4411765), wk = 0.0032895 k( 285) = ( 0.0000000 0.5000000 0.4705882), wk = 0.0032895 k( 286) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032895 k( 287) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0032895 k( 288) = ( 0.5000000 0.5000000 0.0294118), wk = 0.0032895 k( 289) = ( 0.5000000 0.5000000 0.0588235), wk = 0.0032895 k( 290) = ( 0.5000000 0.5000000 0.0882353), wk = 0.0032895 k( 291) = ( 0.5000000 0.5000000 0.1176471), wk = 0.0032895 k( 292) = ( 0.5000000 0.5000000 0.1470588), wk = 0.0032895 k( 293) = ( 0.5000000 0.5000000 0.1764706), wk = 0.0032895 k( 294) = ( 0.5000000 0.5000000 0.2058823), wk = 0.0032895 k( 295) = ( 0.5000000 0.5000000 0.2352941), wk = 0.0032895 k( 296) = ( 0.5000000 0.5000000 0.2647059), wk = 0.0032895 k( 297) = ( 0.5000000 0.5000000 0.2941177), wk = 0.0032895 k( 298) = ( 0.5000000 0.5000000 0.3235294), wk = 0.0032895 k( 299) = ( 0.5000000 0.5000000 0.3529412), wk = 0.0032895 k( 300) = ( 0.5000000 0.5000000 0.3823529), wk = 0.0032895 k( 301) = ( 0.5000000 0.5000000 0.4117647), wk = 0.0032895 k( 302) = ( 0.5000000 0.5000000 0.4411765), wk = 0.0032895 k( 303) = ( 0.5000000 0.5000000 0.4705882), wk = 0.0032895 k( 304) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032895 Dense grid: 127153 G-vectors FFT dimensions: ( 50, 50, 108) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 1.25 Mb ( 934, 88) NL pseudopotentials 1.67 Mb ( 467, 234) Each V/rho on FFT grid 0.11 Mb ( 7500) Each G-vector array 0.03 Mb ( 3536) G-vector shells 0.01 Mb ( 1646) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 5.02 Mb ( 934, 352) Each subspace H/S matrix 0.12 Mb ( 88, 88) Each matrix 0.63 Mb ( 234, 2, 88) The potential is recalculated from file : ./BaMnSbF.save/charge-density.dat Starting wfc are 92 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.6 secs Computing kpt #: 2 total cpu time spent up to now is 6.4 secs Computing kpt #: 3 total cpu time spent up to now is 8.3 secs Computing kpt #: 4 total cpu time spent up to now is 10.3 secs Computing kpt #: 5 total cpu time spent up to now is 12.2 secs Computing kpt #: 6 total cpu time spent up to now is 14.1 secs Computing kpt #: 7 total cpu time spent up to now is 15.9 secs Computing kpt #: 8 total cpu time spent up to now is 17.8 secs Computing kpt #: 9 total cpu time spent up to now is 19.6 secs Computing kpt #: 10 total cpu time spent up to now is 21.4 secs Computing kpt #: 11 total cpu time spent up to now is 23.2 secs Computing kpt #: 12 total cpu time spent up to now is 25.0 secs Computing kpt #: 13 total cpu time spent up to now is 26.8 secs Computing kpt #: 14 total cpu time spent up to now is 28.7 secs Computing kpt #: 15 total cpu time spent up to now is 30.6 secs Computing kpt #: 16 total cpu time spent up to now is 32.4 secs Computing kpt #: 17 total cpu time spent up to now is 34.3 secs Computing kpt #: 18 total cpu time spent up to now is 36.2 secs Computing kpt #: 19 total cpu time spent up to now is 38.0 secs Computing kpt #: 20 total cpu time spent up to now is 39.9 secs Computing kpt #: 21 total cpu time spent up to now is 41.8 secs Computing kpt #: 22 total cpu time spent up to now is 43.6 secs Computing kpt #: 23 total cpu time spent up to now is 45.5 secs Computing kpt #: 24 total cpu time spent up to now is 47.4 secs Computing kpt #: 25 total cpu time spent up to now is 49.4 secs Computing kpt #: 26 total cpu time spent up to now is 51.4 secs Computing kpt #: 27 total cpu time spent up to now is 53.3 secs Computing kpt #: 28 total cpu time spent up to now is 55.2 secs Computing kpt #: 29 total cpu time spent up to now is 57.2 secs Computing kpt #: 30 total cpu time spent up to now is 59.1 secs Computing kpt #: 31 total cpu time spent up to now is 61.1 secs Computing kpt #: 32 total cpu time spent up to now is 63.1 secs Computing kpt #: 33 total cpu time spent up to now is 65.0 secs Computing kpt #: 34 total cpu time spent up to now is 67.0 secs Computing kpt #: 35 total cpu time spent up to now is 68.9 secs Computing kpt #: 36 total cpu time spent up to now is 70.8 secs Computing kpt #: 37 total cpu time spent up to now is 72.7 secs Computing kpt #: 38 total cpu time spent up to now is 74.6 secs Computing kpt #: 39 total cpu time spent up to now is 76.5 secs Computing kpt #: 40 total cpu time spent up to now is 78.3 secs Computing kpt #: 41 total cpu time spent up to now is 80.2 secs Computing kpt #: 42 total cpu time spent up to now is 82.1 secs Computing kpt #: 43 total cpu time spent up to now is 84.0 secs Computing kpt #: 44 total cpu time spent up to now is 85.9 secs Computing kpt #: 45 total cpu time spent up to now is 87.8 secs Computing kpt #: 46 total cpu time spent up to now is 89.7 secs Computing kpt #: 47 total cpu time spent up to now is 91.6 secs Computing kpt #: 48 total cpu time spent up to now is 93.5 secs Computing kpt #: 49 total cpu time spent up to now is 95.4 secs Computing kpt #: 50 total cpu time spent up to now is 97.3 secs Computing kpt #: 51 total cpu time spent up to now is 99.3 secs Computing kpt #: 52 total cpu time spent up to now is 101.2 secs Computing kpt #: 53 total cpu time spent up to now is 103.1 secs Computing kpt #: 54 total cpu time spent up to now is 105.0 secs Computing kpt #: 55 total cpu time spent up to now is 106.9 secs Computing kpt #: 56 total cpu time spent up to now is 108.8 secs Computing kpt #: 57 total cpu time spent up to now is 110.7 secs Computing kpt #: 58 total cpu time spent up to now is 112.6 secs Computing kpt #: 59 total cpu time spent up to now is 114.5 secs Computing kpt #: 60 total cpu time spent up to now is 116.4 secs Computing kpt #: 61 total cpu time spent up to now is 118.3 secs Computing kpt #: 62 total cpu time spent up to now is 120.2 secs Computing kpt #: 63 total cpu time spent up to now is 122.1 secs Computing kpt #: 64 total cpu time spent up to now is 123.9 secs Computing kpt #: 65 total cpu time spent up to now is 125.8 secs Computing kpt #: 66 total cpu time spent up to now is 127.7 secs Computing kpt #: 67 total cpu time spent up to now is 129.5 secs Computing kpt #: 68 total cpu time spent up to now is 131.4 secs Computing kpt #: 69 total cpu time spent up to now is 133.3 secs Computing kpt #: 70 total cpu time spent up to now is 135.2 secs Computing kpt #: 71 total cpu time spent up to now is 137.1 secs Computing kpt #: 72 total cpu time spent up to now is 138.9 secs Computing kpt #: 73 total cpu time spent up to now is 140.8 secs Computing kpt #: 74 total cpu time spent up to now is 142.7 secs Computing kpt #: 75 total cpu time spent up to now is 144.6 secs Computing kpt #: 76 total cpu time spent up to now is 146.5 secs Computing kpt #: 77 total cpu time spent up to now is 148.4 secs Computing kpt #: 78 total cpu time spent up to now is 150.3 secs Computing kpt #: 79 total cpu time spent up to now is 152.2 secs Computing kpt #: 80 total cpu time spent up to now is 154.1 secs Computing kpt #: 81 total cpu time spent up to now is 156.1 secs Computing kpt #: 82 total cpu time spent up to now is 158.0 secs Computing kpt #: 83 total cpu time spent up to now is 159.9 secs Computing kpt #: 84 total cpu time spent up to now is 161.7 secs Computing kpt #: 85 total cpu time spent up to now is 163.6 secs Computing kpt #: 86 total cpu time spent up to now is 165.5 secs Computing kpt #: 87 total cpu time spent up to now is 167.3 secs Computing kpt #: 88 total cpu time spent up to now is 169.2 secs Computing kpt #: 89 total cpu time spent up to now is 171.0 secs Computing kpt #: 90 total cpu time spent up to now is 172.8 secs Computing kpt #: 91 total cpu time spent up to now is 174.7 secs Computing kpt #: 92 total cpu time spent up to now is 176.5 secs Computing kpt #: 93 total cpu time spent up to now is 178.4 secs Computing kpt #: 94 total cpu time spent up to now is 180.2 secs Computing kpt #: 95 total cpu time spent up to now is 182.0 secs Computing kpt #: 96 total cpu time spent up to now is 183.9 secs Computing kpt #: 97 total cpu time spent up to now is 185.7 secs Computing kpt #: 98 total cpu time spent up to now is 187.5 secs Computing kpt #: 99 total cpu time spent up to now is 189.4 secs Computing kpt #: 100 total cpu time spent up to now is 191.2 secs Computing kpt #: 101 total cpu time spent up to now is 193.6 secs Computing kpt #: 102 total cpu time spent up to now is 195.5 secs Computing kpt #: 103 total cpu time spent up to now is 197.3 secs Computing kpt #: 104 total cpu time spent up to now is 199.1 secs Computing kpt #: 105 total cpu time spent up to now is 200.9 secs Computing kpt #: 106 total cpu time spent up to now is 202.8 secs Computing kpt #: 107 total cpu time spent up to now is 204.6 secs Computing kpt #: 108 total cpu time spent up to now is 206.6 secs Computing kpt #: 109 total cpu time spent up to now is 208.5 secs Computing kpt #: 110 total cpu time spent up to now is 210.4 secs Computing kpt #: 111 total cpu time spent up to now is 212.3 secs Computing kpt #: 112 total cpu time spent up to now is 214.1 secs Computing kpt #: 113 total cpu time spent up to now is 216.0 secs Computing kpt #: 114 total cpu time spent up to now is 217.8 secs Computing kpt #: 115 total cpu time spent up to now is 219.6 secs Computing kpt #: 116 total cpu time spent up to now is 221.5 secs Computing kpt #: 117 total cpu time spent up to now is 223.3 secs Computing kpt #: 118 total cpu time spent up to now is 225.2 secs Computing kpt #: 119 total cpu time spent up to now is 227.0 secs Computing kpt #: 120 total cpu time spent up to now is 228.9 secs Computing kpt #: 121 total cpu time spent up to now is 230.8 secs Computing kpt #: 122 total cpu time spent up to now is 232.6 secs Computing kpt #: 123 total cpu time spent up to now is 234.5 secs Computing kpt #: 124 total cpu time spent up to now is 236.3 secs Computing kpt #: 125 total cpu time spent up to now is 238.2 secs Computing kpt #: 126 total cpu time spent up to now is 240.0 secs Computing kpt #: 127 total cpu time spent up to now is 241.8 secs Computing kpt #: 128 total cpu time spent up to now is 243.7 secs Computing kpt #: 129 total cpu time spent up to now is 245.6 secs Computing kpt #: 130 total cpu time spent up to now is 247.5 secs Computing kpt #: 131 total cpu time spent up to now is 249.5 secs Computing kpt #: 132 total cpu time spent up to now is 251.4 secs Computing kpt #: 133 total cpu time spent up to now is 253.4 secs Computing kpt #: 134 total cpu time spent up to now is 255.3 secs Computing kpt #: 135 total cpu time spent up to now is 257.3 secs Computing kpt #: 136 total cpu time spent up to now is 259.3 secs Computing kpt #: 137 total cpu time spent up to now is 261.4 secs Computing kpt #: 138 total cpu time spent up to now is 263.4 secs Computing kpt #: 139 total cpu time spent up to now is 265.3 secs Computing kpt #: 140 total cpu time spent up to now is 267.3 secs Computing kpt #: 141 total cpu time spent up to now is 269.5 secs Computing kpt #: 142 total cpu time spent up to now is 271.7 secs Computing kpt #: 143 total cpu time spent up to now is 273.9 secs Computing kpt #: 144 total cpu time spent up to now is 276.2 secs Computing kpt #: 145 total cpu time spent up to now is 278.5 secs Computing kpt #: 146 total cpu time spent up to now is 280.7 secs Computing kpt #: 147 total cpu time spent up to now is 282.7 secs Computing kpt #: 148 total cpu time spent up to now is 284.7 secs Computing kpt #: 149 total cpu time spent up to now is 286.7 secs Computing kpt #: 150 total cpu time spent up to now is 288.6 secs Computing kpt #: 151 total cpu time spent up to now is 290.6 secs Computing kpt #: 152 total cpu time spent up to now is 292.5 secs Computing kpt #: 153 total cpu time spent up to now is 294.4 secs Computing kpt #: 154 total cpu time spent up to now is 296.3 secs Computing kpt #: 155 total cpu time spent up to now is 298.2 secs Computing kpt #: 156 total cpu time spent up to now is 300.0 secs Computing kpt #: 157 total cpu time spent up to now is 301.9 secs Computing kpt #: 158 total cpu time spent up to now is 303.8 secs Computing kpt #: 159 total cpu time spent up to now is 305.7 secs Computing kpt #: 160 total cpu time spent up to now is 307.6 secs Computing kpt #: 161 total cpu time spent up to now is 309.5 secs Computing kpt #: 162 total cpu time spent up to now is 311.3 secs Computing kpt #: 163 total cpu time spent up to now is 313.2 secs Computing kpt #: 164 total cpu time spent up to now is 315.1 secs Computing kpt #: 165 total cpu time spent up to now is 316.9 secs Computing kpt #: 166 total cpu time spent up to now is 318.7 secs Computing kpt #: 167 total cpu time spent up to now is 320.6 secs Computing kpt #: 168 total cpu time spent up to now is 322.4 secs Computing kpt #: 169 total cpu time spent up to now is 324.2 secs Computing kpt #: 170 total cpu time spent up to now is 326.1 secs Computing kpt #: 171 total cpu time spent up to now is 328.0 secs Computing kpt #: 172 total cpu time spent up to now is 329.9 secs Computing kpt #: 173 total cpu time spent up to now is 331.8 secs Computing kpt #: 174 total cpu time spent up to now is 333.8 secs Computing kpt #: 175 total cpu time spent up to now is 335.8 secs Computing kpt #: 176 total cpu time spent up to now is 337.7 secs Computing kpt #: 177 total cpu time spent up to now is 339.6 secs Computing kpt #: 178 total cpu time spent up to now is 341.6 secs Computing kpt #: 179 total cpu time spent up to now is 343.5 secs Computing kpt #: 180 total cpu time spent up to now is 345.3 secs Computing kpt #: 181 total cpu time spent up to now is 347.2 secs Computing kpt #: 182 total cpu time spent up to now is 349.1 secs Computing kpt #: 183 total cpu time spent up to now is 351.0 secs Computing kpt #: 184 total cpu time spent up to now is 352.9 secs Computing kpt #: 185 total cpu time spent up to now is 354.8 secs Computing kpt #: 186 total cpu time spent up to now is 356.7 secs Computing kpt #: 187 total cpu time spent up to now is 358.6 secs Computing kpt #: 188 total cpu time spent up to now is 360.5 secs Computing kpt #: 189 total cpu time spent up to now is 362.4 secs Computing kpt #: 190 total cpu time spent up to now is 364.3 secs Computing kpt #: 191 total cpu time spent up to now is 366.2 secs Computing kpt #: 192 total cpu time spent up to now is 368.1 secs Computing kpt #: 193 total cpu time spent up to now is 370.0 secs Computing kpt #: 194 total cpu time spent up to now is 371.9 secs Computing kpt #: 195 total cpu time spent up to now is 373.8 secs Computing kpt #: 196 total cpu time spent up to now is 375.7 secs Computing kpt #: 197 total cpu time spent up to now is 377.6 secs Computing kpt #: 198 total cpu time spent up to now is 379.6 secs Computing kpt #: 199 total cpu time spent up to now is 381.5 secs Computing kpt #: 200 total cpu time spent up to now is 383.5 secs Computing kpt #: 201 total cpu time spent up to now is 385.4 secs Computing kpt #: 202 total cpu time spent up to now is 387.4 secs Computing kpt #: 203 total cpu time spent up to now is 389.3 secs Computing kpt #: 204 total cpu time spent up to now is 391.3 secs Computing kpt #: 205 total cpu time spent up to now is 393.2 secs Computing kpt #: 206 total cpu time spent up to now is 395.2 secs Computing kpt #: 207 total cpu time spent up to now is 397.1 secs Computing kpt #: 208 total cpu time spent up to now is 399.1 secs Computing kpt #: 209 total cpu time spent up to now is 401.0 secs Computing kpt #: 210 total cpu time spent up to now is 402.9 secs Computing kpt #: 211 total cpu time spent up to now is 404.9 secs Computing kpt #: 212 total cpu time spent up to now is 406.8 secs Computing kpt #: 213 total cpu time spent up to now is 408.7 secs Computing kpt #: 214 total cpu time spent up to now is 410.6 secs Computing kpt #: 215 total cpu time spent up to now is 412.5 secs Computing kpt #: 216 total cpu time spent up to now is 414.4 secs Computing kpt #: 217 total cpu time spent up to now is 416.3 secs Computing kpt #: 218 total cpu time spent up to now is 418.2 secs Computing kpt #: 219 total cpu time spent up to now is 420.0 secs Computing kpt #: 220 total cpu time spent up to now is 422.0 secs Computing kpt #: 221 total cpu time spent up to now is 423.9 secs Computing kpt #: 222 total cpu time spent up to now is 425.8 secs Computing kpt #: 223 total cpu time spent up to now is 427.7 secs Computing kpt #: 224 total cpu time spent up to now is 429.6 secs Computing kpt #: 225 total cpu time spent up to now is 431.6 secs Computing kpt #: 226 total cpu time spent up to now is 433.6 secs Computing kpt #: 227 total cpu time spent up to now is 435.6 secs Computing kpt #: 228 total cpu time spent up to now is 437.6 secs Computing kpt #: 229 total cpu time spent up to now is 439.6 secs Computing kpt #: 230 total cpu time spent up to now is 441.6 secs Computing kpt #: 231 total cpu time spent up to now is 443.5 secs Computing kpt #: 232 total cpu time spent up to now is 445.5 secs Computing kpt #: 233 total cpu time spent up to now is 447.5 secs Computing kpt #: 234 total cpu time spent up to now is 449.5 secs Computing kpt #: 235 total cpu time spent up to now is 451.5 secs Computing kpt #: 236 total cpu time spent up to now is 453.4 secs Computing kpt #: 237 total cpu time spent up to now is 455.4 secs Computing kpt #: 238 total cpu time spent up to now is 457.4 secs Computing kpt #: 239 total cpu time spent up to now is 459.3 secs Computing kpt #: 240 total cpu time spent up to now is 461.2 secs Computing kpt #: 241 total cpu time spent up to now is 463.1 secs Computing kpt #: 242 total cpu time spent up to now is 465.0 secs Computing kpt #: 243 total cpu time spent up to now is 466.9 secs Computing kpt #: 244 total cpu time spent up to now is 468.8 secs Computing kpt #: 245 total cpu time spent up to now is 470.7 secs Computing kpt #: 246 total cpu time spent up to now is 472.6 secs Computing kpt #: 247 total cpu time spent up to now is 474.5 secs Computing kpt #: 248 total cpu time spent up to now is 476.4 secs Computing kpt #: 249 total cpu time spent up to now is 478.3 secs Computing kpt #: 250 total cpu time spent up to now is 480.3 secs Computing kpt #: 251 total cpu time spent up to now is 482.3 secs Computing kpt #: 252 total cpu time spent up to now is 484.2 secs Computing kpt #: 253 total cpu time spent up to now is 486.2 secs Computing kpt #: 254 total cpu time spent up to now is 488.2 secs Computing kpt #: 255 total cpu time spent up to now is 490.4 secs Computing kpt #: 256 total cpu time spent up to now is 493.1 secs Computing kpt #: 257 total cpu time spent up to now is 495.4 secs Computing kpt #: 258 total cpu time spent up to now is 497.7 secs Computing kpt #: 259 total cpu time spent up to now is 499.7 secs Computing kpt #: 260 total cpu time spent up to now is 501.7 secs Computing kpt #: 261 total cpu time spent up to now is 503.7 secs Computing kpt #: 262 total cpu time spent up to now is 505.7 secs Computing kpt #: 263 total cpu time spent up to now is 507.7 secs Computing kpt #: 264 total cpu time spent up to now is 509.7 secs Computing kpt #: 265 total cpu time spent up to now is 512.0 secs Computing kpt #: 266 total cpu time spent up to now is 514.2 secs Computing kpt #: 267 total cpu time spent up to now is 516.5 secs Computing kpt #: 268 total cpu time spent up to now is 518.7 secs Computing kpt #: 269 total cpu time spent up to now is 520.6 secs Computing kpt #: 270 total cpu time spent up to now is 522.5 secs Computing kpt #: 271 total cpu time spent up to now is 524.4 secs Computing kpt #: 272 total cpu time spent up to now is 526.4 secs Computing kpt #: 273 total cpu time spent up to now is 528.2 secs Computing kpt #: 274 total cpu time spent up to now is 530.1 secs Computing kpt #: 275 total cpu time spent up to now is 532.0 secs Computing kpt #: 276 total cpu time spent up to now is 533.9 secs Computing kpt #: 277 total cpu time spent up to now is 535.8 secs Computing kpt #: 278 total cpu time spent up to now is 537.6 secs Computing kpt #: 279 total cpu time spent up to now is 539.5 secs Computing kpt #: 280 total cpu time spent up to now is 541.4 secs Computing kpt #: 281 total cpu time spent up to now is 543.3 secs Computing kpt #: 282 total cpu time spent up to now is 545.2 secs Computing kpt #: 283 total cpu time spent up to now is 547.1 secs Computing kpt #: 284 total cpu time spent up to now is 549.0 secs Computing kpt #: 285 total cpu time spent up to now is 550.8 secs Computing kpt #: 286 total cpu time spent up to now is 552.7 secs Computing kpt #: 287 total cpu time spent up to now is 554.6 secs Computing kpt #: 288 total cpu time spent up to now is 556.5 secs Computing kpt #: 289 total cpu time spent up to now is 558.4 secs Computing kpt #: 290 total cpu time spent up to now is 560.3 secs Computing kpt #: 291 total cpu time spent up to now is 562.2 secs Computing kpt #: 292 total cpu time spent up to now is 564.1 secs Computing kpt #: 293 total cpu time spent up to now is 566.0 secs Computing kpt #: 294 total cpu time spent up to now is 567.9 secs Computing kpt #: 295 total cpu time spent up to now is 569.8 secs Computing kpt #: 296 total cpu time spent up to now is 571.7 secs Computing kpt #: 297 total cpu time spent up to now is 573.6 secs Computing kpt #: 298 total cpu time spent up to now is 575.5 secs Computing kpt #: 299 total cpu time spent up to now is 577.4 secs Computing kpt #: 300 total cpu time spent up to now is 579.3 secs Computing kpt #: 301 total cpu time spent up to now is 581.1 secs Computing kpt #: 302 total cpu time spent up to now is 583.0 secs Computing kpt #: 303 total cpu time spent up to now is 585.0 secs Computing kpt #: 304 total cpu time spent up to now is 586.9 secs ethr = 1.35E-08, avg # of iterations = 17.9 total cpu time spent up to now is 586.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 15829 PWs) bands (ev): -69.8724 -69.8724 -69.8622 -69.8622 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4637 -38.4637 -38.3901 -38.3901 -38.3862 -38.3862 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1667 -6.1667 -6.0376 -6.0376 -4.3276 -4.3276 -4.1262 -4.1262 -4.0350 -4.0350 -3.9997 -3.9997 -1.0922 -1.0922 -0.3859 -0.3859 2.2950 2.2950 2.3120 2.3120 2.3604 2.3604 2.4554 2.4554 2.8874 2.8874 2.9534 2.9534 4.8963 4.8963 5.9846 5.9846 6.3756 6.3756 6.5208 6.5208 6.8483 6.8483 7.1505 7.1505 7.2125 7.2125 8.1204 8.1204 8.2130 8.2130 8.6408 8.6408 8.7406 8.7406 8.7430 8.7430 8.8267 8.8267 9.2265 9.2265 10.2816 10.2816 10.5233 10.5233 10.6749 10.6749 10.9213 10.9213 k = 0.0000 0.0139-0.0000 ( 15814 PWs) bands (ev): -69.8725 -69.8725 -69.8612 -69.8612 -39.6510 -39.6510 -39.6332 -39.6332 -38.4942 -38.4942 -38.4637 -38.4637 -38.3901 -38.3901 -38.3862 -38.3862 -19.6409 -19.6409 -19.4425 -19.4425 -15.8094 -15.8094 -15.7890 -15.7890 -6.1669 -6.1669 -6.0375 -6.0375 -4.3277 -4.3277 -4.1273 -4.1273 -4.0342 -4.0342 -3.9996 -3.9996 -1.0914 -1.0914 -0.3855 -0.3855 2.2953 2.2953 2.3125 2.3125 2.3607 2.3607 2.4556 2.4556 2.8872 2.8872 2.9532 2.9532 4.8978 4.8978 5.9854 5.9854 6.3767 6.3767 6.5221 6.5221 6.8458 6.8458 7.1477 7.1477 7.2130 7.2130 8.1226 8.1226 8.2131 8.2131 8.6288 8.6288 8.7413 8.7413 8.7491 8.7491 8.8295 8.8295 9.2297 9.2297 10.2760 10.2760 10.5119 10.5119 10.6785 10.6785 10.9323 10.9323 k = 0.0000 0.0278-0.0000 ( 15812 PWs) bands (ev): -69.8724 -69.8724 -69.8612 -69.8612 -39.6510 -39.6510 -39.6332 -39.6332 -38.4942 -38.4942 -38.4637 -38.4637 -38.3901 -38.3901 -38.3862 -38.3862 -19.6404 -19.6404 -19.4425 -19.4425 -15.8098 -15.8098 -15.7895 -15.7895 -6.1675 -6.1675 -6.0373 -6.0373 -4.3281 -4.3281 -4.1303 -4.1303 -4.0320 -4.0320 -3.9994 -3.9994 -1.0891 -1.0891 -0.3845 -0.3845 2.2962 2.2962 2.3138 2.3138 2.3613 2.3613 2.4561 2.4561 2.8867 2.8867 2.9526 2.9526 4.9024 4.9024 5.9849 5.9849 6.3743 6.3743 6.5196 6.5196 6.8385 6.8385 7.1397 7.1397 7.2148 7.2148 8.1260 8.1260 8.2148 8.2148 8.6011 8.6011 8.7380 8.7380 8.7631 8.7631 8.8406 8.8406 9.2320 9.2320 10.2499 10.2499 10.4800 10.4800 10.6880 10.6880 10.9538 10.9538 k = 0.0000 0.0417-0.0000 ( 15810 PWs) bands (ev): -69.8716 -69.8716 -69.8618 -69.8618 -39.6510 -39.6510 -39.6332 -39.6332 -38.4942 -38.4942 -38.4638 -38.4638 -38.3901 -38.3901 -38.3861 -38.3861 -19.6395 -19.6395 -19.4425 -19.4425 -15.8106 -15.8106 -15.7902 -15.7902 -6.1684 -6.1684 -6.0369 -6.0369 -4.3287 -4.3287 -4.1350 -4.1350 -4.0289 -4.0289 -3.9989 -3.9989 -1.0853 -1.0853 -0.3827 -0.3827 2.2978 2.2978 2.3161 2.3161 2.3624 2.3624 2.4569 2.4569 2.8857 2.8857 2.9516 2.9516 4.9100 4.9100 5.9833 5.9833 6.3687 6.3687 6.5144 6.5144 6.8261 6.8261 7.1273 7.1273 7.2201 7.2201 8.1309 8.1309 8.2191 8.2191 8.5680 8.5680 8.7357 8.7357 8.7717 8.7717 8.8615 8.8615 9.2351 9.2351 10.2029 10.2029 10.4450 10.4450 10.7036 10.7036 10.9748 10.9748 k = 0.0000 0.0556-0.0000 ( 15818 PWs) bands (ev): -69.8716 -69.8716 -69.8623 -69.8623 -39.6509 -39.6509 -39.6333 -39.6333 -38.4941 -38.4941 -38.4639 -38.4639 -38.3901 -38.3901 -38.3862 -38.3862 -19.6382 -19.6382 -19.4425 -19.4425 -15.8116 -15.8116 -15.7913 -15.7913 -6.1696 -6.1696 -6.0364 -6.0364 -4.3295 -4.3295 -4.1407 -4.1407 -4.0254 -4.0254 -3.9981 -3.9981 -1.0800 -1.0800 -0.3802 -0.3802 2.2999 2.2999 2.3192 2.3192 2.3640 2.3640 2.4581 2.4581 2.8843 2.8843 2.9502 2.9502 4.9200 4.9200 5.9814 5.9814 6.3610 6.3610 6.5090 6.5090 6.8077 6.8077 7.1110 7.1110 7.2235 7.2235 8.1369 8.1369 8.2212 8.2212 8.5341 8.5341 8.7308 8.7308 8.7707 8.7707 8.8880 8.8880 9.2385 9.2385 10.1403 10.1403 10.4165 10.4165 10.7251 10.7251 10.9964 10.9964 k = 0.0000 0.0694-0.0000 ( 15816 PWs) bands (ev): -69.8703 -69.8703 -69.8634 -69.8634 -39.6509 -39.6509 -39.6333 -39.6333 -38.4940 -38.4940 -38.4640 -38.4640 -38.3901 -38.3901 -38.3861 -38.3861 -19.6366 -19.6366 -19.4425 -19.4425 -15.8130 -15.8130 -15.7927 -15.7927 -6.1711 -6.1711 -6.0358 -6.0358 -4.3306 -4.3306 -4.1471 -4.1471 -4.0220 -4.0220 -3.9969 -3.9969 -1.0731 -1.0731 -0.3771 -0.3771 2.3027 2.3027 2.3232 2.3232 2.3660 2.3660 2.4596 2.4596 2.8825 2.8825 2.9486 2.9486 4.9328 4.9328 5.9788 5.9788 6.3498 6.3498 6.5026 6.5026 6.7839 6.7839 7.0932 7.0932 7.2329 7.2329 8.1425 8.1425 8.2259 8.2259 8.5027 8.5027 8.7271 8.7271 8.7681 8.7681 8.9191 8.9191 9.2389 9.2389 10.0674 10.0674 10.3911 10.3911 10.7515 10.7515 11.0207 11.0207 k = 0.0000 0.0833-0.0000 ( 15832 PWs) bands (ev): -69.8705 -69.8705 -69.8641 -69.8641 -39.6508 -39.6508 -39.6334 -39.6334 -38.4939 -38.4939 -38.4642 -38.4642 -38.3901 -38.3901 -38.3862 -38.3862 -19.6347 -19.6347 -19.4425 -19.4425 -15.8145 -15.8145 -15.7943 -15.7943 -6.1728 -6.1728 -6.0352 -6.0352 -4.3319 -4.3319 -4.1538 -4.1538 -4.0193 -4.0193 -3.9951 -3.9951 -1.0647 -1.0647 -0.3733 -0.3733 2.3061 2.3061 2.3280 2.3280 2.3684 2.3684 2.4614 2.4614 2.8800 2.8800 2.9468 2.9468 4.9479 4.9479 5.9751 5.9751 6.3349 6.3349 6.4962 6.4962 6.7537 6.7537 7.0741 7.0741 7.2391 7.2391 8.1481 8.1481 8.2283 8.2283 8.4720 8.4720 8.7169 8.7169 8.7591 8.7591 8.9475 8.9475 9.2468 9.2468 9.9895 9.9895 10.3675 10.3675 10.7826 10.7826 11.0484 11.0484 k = 0.0000 0.0972-0.0000 ( 15838 PWs) bands (ev): -69.8710 -69.8710 -69.8640 -69.8640 -39.6507 -39.6507 -39.6336 -39.6336 -38.4937 -38.4937 -38.4644 -38.4644 -38.3900 -38.3900 -38.3862 -38.3862 -19.6324 -19.6324 -19.4425 -19.4425 -15.8164 -15.8164 -15.7962 -15.7962 -6.1747 -6.1747 -6.0346 -6.0346 -4.3335 -4.3335 -4.1604 -4.1604 -4.0175 -4.0175 -3.9929 -3.9929 -1.0548 -1.0548 -0.3688 -0.3688 2.3101 2.3101 2.3336 2.3336 2.3713 2.3713 2.4635 2.4635 2.8770 2.8770 2.9449 2.9449 4.9651 4.9651 5.9710 5.9710 6.3179 6.3179 6.4920 6.4920 6.7182 6.7182 7.0552 7.0552 7.2451 7.2451 8.1531 8.1531 8.2312 8.2312 8.4446 8.4446 8.7052 8.7052 8.7477 8.7477 8.9753 8.9753 9.2567 9.2567 9.9126 9.9126 10.3459 10.3459 10.8179 10.8179 11.0800 11.0800 k = 0.0000 0.1111-0.0000 ( 15846 PWs) bands (ev): -69.8713 -69.8713 -69.8642 -69.8642 -39.6506 -39.6506 -39.6337 -39.6337 -38.4935 -38.4935 -38.4646 -38.4646 -38.3900 -38.3900 -38.3862 -38.3862 -19.6297 -19.6297 -19.4425 -19.4425 -15.8185 -15.8185 -15.7984 -15.7984 -6.1767 -6.1767 -6.0341 -6.0341 -4.3352 -4.3352 -4.1669 -4.1669 -4.0167 -4.0167 -3.9904 -3.9904 -1.0434 -1.0434 -0.3637 -0.3637 2.3147 2.3147 2.3398 2.3398 2.3746 2.3746 2.4659 2.4659 2.8733 2.8733 2.9430 2.9430 4.9841 4.9841 5.9653 5.9653 6.2976 6.2976 6.4879 6.4879 6.6789 6.6789 7.0372 7.0372 7.2529 7.2529 8.1543 8.1543 8.2333 8.2333 8.4216 8.4216 8.6931 8.6931 8.7348 8.7348 9.0029 9.0029 9.2648 9.2648 9.8373 9.8373 10.3228 10.3228 10.8551 10.8551 11.1154 11.1154 k = 0.0000 0.1250-0.0000 ( 15842 PWs) bands (ev): -69.8715 -69.8715 -69.8637 -69.8637 -39.6504 -39.6504 -39.6338 -39.6338 -38.4932 -38.4932 -38.4649 -38.4649 -38.3900 -38.3900 -38.3863 -38.3863 -19.6268 -19.6268 -19.4426 -19.4426 -15.8208 -15.8208 -15.8008 -15.8008 -6.1787 -6.1787 -6.0337 -6.0337 -4.3371 -4.3371 -4.1730 -4.1730 -4.0166 -4.0166 -3.9880 -3.9880 -1.0306 -1.0306 -0.3581 -0.3581 2.3199 2.3199 2.3466 2.3466 2.3785 2.3785 2.4686 2.4686 2.8689 2.8689 2.9410 2.9410 5.0050 5.0050 5.9562 5.9562 6.2748 6.2748 6.4852 6.4852 6.6378 6.6378 7.0204 7.0204 7.2618 7.2618 8.1529 8.1529 8.2358 8.2358 8.4048 8.4048 8.6790 8.6790 8.7205 8.7205 9.0302 9.0302 9.2798 9.2798 9.7660 9.7660 10.2999 10.2999 10.8940 10.8940 11.1545 11.1545 k = 0.0000 0.1389-0.0000 ( 15858 PWs) bands (ev): -69.8719 -69.8719 -69.8643 -69.8643 -39.6503 -39.6503 -39.6340 -39.6340 -38.4930 -38.4930 -38.4652 -38.4652 -38.3900 -38.3900 -38.3863 -38.3863 -19.6236 -19.6236 -19.4427 -19.4427 -15.8233 -15.8233 -15.8035 -15.8035 -6.1807 -6.1807 -6.0335 -6.0335 -4.3390 -4.3390 -4.1786 -4.1786 -4.0172 -4.0172 -3.9859 -3.9859 -1.0162 -1.0162 -0.3520 -0.3520 2.3256 2.3256 2.3540 2.3540 2.3828 2.3828 2.4717 2.4717 2.8638 2.8638 2.9392 2.9392 5.0269 5.0269 5.9429 5.9429 6.2476 6.2476 6.4806 6.4806 6.5973 6.5973 7.0045 7.0045 7.2736 7.2736 8.1461 8.1461 8.2375 8.2375 8.3929 8.3929 8.6620 8.6620 8.7035 8.7035 9.0540 9.0540 9.2905 9.2905 9.6951 9.6951 10.2742 10.2742 10.9331 10.9331 11.1969 11.1969 k = 0.0000 0.1528-0.0000 ( 15862 PWs) bands (ev): -69.8719 -69.8719 -69.8646 -69.8646 -39.6501 -39.6501 -39.6342 -39.6342 -38.4927 -38.4927 -38.4655 -38.4655 -38.3899 -38.3899 -38.3864 -38.3864 -19.6201 -19.6201 -19.4428 -19.4428 -15.8261 -15.8261 -15.8063 -15.8063 -6.1826 -6.1826 -6.0334 -6.0334 -4.3411 -4.3411 -4.1835 -4.1835 -4.0183 -4.0183 -3.9844 -3.9844 -1.0004 -1.0004 -0.3454 -0.3454 2.3319 2.3319 2.3617 2.3617 2.3878 2.3878 2.4749 2.4749 2.8578 2.8578 2.9375 2.9375 5.0497 5.0497 5.9258 5.9258 6.2181 6.2181 6.4746 6.4746 6.5620 6.5620 6.9891 6.9891 7.2870 7.2870 8.1369 8.1369 8.2398 8.2398 8.3865 8.3865 8.6466 8.6466 8.6862 8.6862 9.0785 9.0785 9.3000 9.3000 9.6285 9.6285 10.2489 10.2489 10.9708 10.9708 11.2423 11.2423 k = 0.0000 0.1667-0.0000 ( 15874 PWs) bands (ev): -69.8723 -69.8723 -69.8648 -69.8648 -39.6499 -39.6499 -39.6344 -39.6344 -38.4924 -38.4924 -38.4658 -38.4658 -38.3899 -38.3899 -38.3864 -38.3864 -19.6163 -19.6163 -19.4430 -19.4430 -15.8289 -15.8289 -15.8094 -15.8094 -6.1844 -6.1844 -6.0336 -6.0336 -4.3432 -4.3432 -4.1878 -4.1878 -4.0200 -4.0200 -3.9836 -3.9836 -0.9832 -0.9832 -0.3385 -0.3385 2.3387 2.3387 2.3695 2.3695 2.3935 2.3935 2.4784 2.4784 2.8511 2.8511 2.9358 2.9358 5.0724 5.0724 5.9035 5.9035 6.1861 6.1861 6.4628 6.4628 6.5370 6.5370 6.9748 6.9748 7.3005 7.3005 8.1232 8.1232 8.2382 8.2382 8.3840 8.3840 8.6295 8.6295 8.6684 8.6684 9.1009 9.1009 9.3116 9.3116 9.5653 9.5653 10.2225 10.2225 11.0056 11.0056 11.2901 11.2901 k = 0.0000 0.1806-0.0000 ( 15870 PWs) bands (ev): -69.8719 -69.8719 -69.8650 -69.8650 -39.6497 -39.6497 -39.6346 -39.6346 -38.4921 -38.4921 -38.4662 -38.4662 -38.3899 -38.3899 -38.3865 -38.3865 -19.6122 -19.6122 -19.4433 -19.4433 -15.8319 -15.8319 -15.8126 -15.8126 -6.1860 -6.1860 -6.0341 -6.0341 -4.3452 -4.3452 -4.1914 -4.1914 -4.0221 -4.0221 -3.9836 -3.9836 -0.9645 -0.9645 -0.3312 -0.3312 2.3459 2.3459 2.3774 2.3774 2.4001 2.4001 2.4822 2.4822 2.8437 2.8437 2.9342 2.9342 5.0950 5.0950 5.8760 5.8760 6.1529 6.1529 6.4449 6.4449 6.5250 6.5250 6.9608 6.9608 7.3162 7.3162 8.1121 8.1121 8.2385 8.2385 8.3844 8.3844 8.6106 8.6106 8.6489 8.6489 9.1268 9.1268 9.3229 9.3229 9.5077 9.5077 10.1957 10.1957 11.0358 11.0358 11.3399 11.3399 k = 0.0000 0.1944-0.0000 ( 15878 PWs) bands (ev): -69.8723 -69.8723 -69.8650 -69.8650 -39.6495 -39.6495 -39.6348 -39.6348 -38.4917 -38.4917 -38.4666 -38.4666 -38.3898 -38.3898 -38.3865 -38.3865 -19.6079 -19.6079 -19.4436 -19.4436 -15.8351 -15.8351 -15.8160 -15.8160 -6.1874 -6.1874 -6.0349 -6.0349 -4.3470 -4.3470 -4.1943 -4.1943 -4.0247 -4.0247 -3.9845 -3.9845 -0.9446 -0.9446 -0.3238 -0.3238 2.3535 2.3535 2.3849 2.3849 2.4078 2.4078 2.4861 2.4861 2.8356 2.8356 2.9327 2.9327 5.1164 5.1164 5.8426 5.8426 6.1182 6.1182 6.4258 6.4258 6.5221 6.5221 6.9469 6.9469 7.3307 7.3307 8.0962 8.0962 8.2376 8.2376 8.3858 8.3858 8.5907 8.5907 8.6280 8.6280 9.1489 9.1489 9.3360 9.3360 9.4531 9.4531 10.1692 10.1692 11.0600 11.0600 11.3907 11.3907 k = 0.0000 0.2083-0.0000 ( 15882 PWs) bands (ev): -69.8727 -69.8727 -69.8648 -69.8648 -39.6493 -39.6493 -39.6351 -39.6351 -38.4913 -38.4913 -38.4670 -38.4670 -38.3897 -38.3897 -38.3866 -38.3866 -19.6033 -19.6033 -19.4441 -19.4441 -15.8383 -15.8383 -15.8195 -15.8195 -6.1885 -6.1885 -6.0360 -6.0360 -4.3486 -4.3486 -4.1965 -4.1965 -4.0278 -4.0278 -3.9862 -3.9862 -0.9233 -0.9233 -0.3162 -0.3162 2.3615 2.3615 2.3921 2.3921 2.4166 2.4166 2.4902 2.4902 2.8268 2.8268 2.9310 2.9310 5.1359 5.1359 5.8039 5.8039 6.0847 6.0847 6.4096 6.4096 6.5234 6.5234 6.9334 6.9334 7.3472 7.3472 8.0808 8.0808 8.2360 8.2360 8.3891 8.3891 8.5685 8.5685 8.6049 8.6049 9.1712 9.1712 9.3475 9.3475 9.4052 9.4052 10.1415 10.1415 11.0773 11.0773 11.4417 11.4417 k = 0.0000 0.2222-0.0000 ( 15876 PWs) bands (ev): -69.8723 -69.8723 -69.8649 -69.8649 -39.6491 -39.6491 -39.6353 -39.6353 -38.4909 -38.4909 -38.4675 -38.4675 -38.3897 -38.3897 -38.3867 -38.3867 -19.5986 -19.5986 -19.4446 -19.4446 -15.8415 -15.8415 -15.8231 -15.8231 -6.1893 -6.1893 -6.0374 -6.0374 -4.3499 -4.3499 -4.1981 -4.1981 -4.0314 -4.0314 -3.9889 -3.9889 -0.9008 -0.9008 -0.3086 -0.3086 2.3699 2.3699 2.3989 2.3989 2.4265 2.4265 2.4944 2.4944 2.8175 2.8175 2.9291 2.9291 5.1527 5.1527 5.7602 5.7602 6.0536 6.0536 6.3981 6.3981 6.5270 6.5270 6.9200 6.9200 7.3682 7.3682 8.0677 8.0677 8.2360 8.2360 8.3900 8.3900 8.5468 8.5468 8.5822 8.5822 9.1940 9.1940 9.3471 9.3471 9.3740 9.3740 10.1136 10.1136 11.0860 11.0860 11.4919 11.4919 k = 0.0000 0.2361-0.0000 ( 15882 PWs) bands (ev): -69.8726 -69.8726 -69.8649 -69.8649 -39.6488 -39.6488 -39.6356 -39.6356 -38.4905 -38.4905 -38.4679 -38.4679 -38.3896 -38.3896 -38.3867 -38.3867 -19.5937 -19.5937 -19.4453 -19.4453 -15.8448 -15.8448 -15.8268 -15.8268 -6.1898 -6.1898 -6.0392 -6.0392 -4.3508 -4.3508 -4.1989 -4.1989 -4.0355 -4.0355 -3.9923 -3.9923 -0.8772 -0.8772 -0.3012 -0.3012 2.3784 2.3784 2.4055 2.4055 2.4373 2.4373 2.4987 2.4987 2.8077 2.8077 2.9270 2.9270 5.1657 5.1657 5.7121 5.7121 6.0272 6.0272 6.3911 6.3911 6.5320 6.5320 6.9062 6.9062 7.3876 7.3876 8.0529 8.0529 8.2341 8.2341 8.3889 8.3889 8.5234 8.5234 8.5580 8.5580 9.2139 9.2139 9.3156 9.3156 9.3779 9.3779 10.0853 10.0853 11.0866 11.0866 11.5399 11.5399 k = 0.0000 0.2500-0.0000 ( 15876 PWs) bands (ev): -69.8720 -69.8720 -69.8651 -69.8651 -39.6485 -39.6485 -39.6359 -39.6359 -38.4900 -38.4900 -38.4684 -38.4684 -38.3896 -38.3896 -38.3868 -38.3868 -19.5886 -19.5886 -19.4461 -19.4461 -15.8481 -15.8481 -15.8306 -15.8306 -6.1899 -6.1899 -6.0413 -6.0413 -4.3512 -4.3512 -4.1992 -4.1992 -4.0402 -4.0402 -3.9966 -3.9966 -0.8524 -0.8524 -0.2941 -0.2941 2.3872 2.3872 2.4120 2.4120 2.4488 2.4488 2.5031 2.5031 2.7975 2.7975 2.9245 2.9245 5.1742 5.1742 5.6607 5.6607 6.0060 6.0060 6.3878 6.3878 6.5378 6.5378 6.8930 6.8930 7.4103 7.4103 8.0417 8.0417 8.2327 8.2327 8.3874 8.3874 8.5009 8.5009 8.5348 8.5348 9.2308 9.2308 9.2845 9.2845 9.3903 9.3903 10.0564 10.0564 11.0796 11.0796 11.5841 11.5841 k = 0.0000 0.2639-0.0000 ( 15880 PWs) bands (ev): -69.8715 -69.8715 -69.8658 -69.8658 -39.6483 -39.6483 -39.6361 -39.6361 -38.4896 -38.4896 -38.4689 -38.4689 -38.3895 -38.3895 -38.3868 -38.3868 -19.5833 -19.5833 -19.4470 -19.4470 -15.8514 -15.8514 -15.8344 -15.8344 -6.1897 -6.1897 -6.0438 -6.0438 -4.3511 -4.3511 -4.1989 -4.1989 -4.0455 -4.0455 -4.0016 -4.0016 -0.8267 -0.8267 -0.2873 -0.2873 2.3961 2.3961 2.4185 2.4185 2.4609 2.4609 2.5075 2.5075 2.7869 2.7869 2.9215 2.9215 5.1778 5.1778 5.6070 5.6070 5.9925 5.9925 6.3871 6.3871 6.5437 6.5437 6.8801 6.8801 7.4313 7.4313 8.0311 8.0311 8.2311 8.2311 8.3808 8.3808 8.4772 8.4772 8.5107 8.5107 9.2291 9.2291 9.2755 9.2755 9.4000 9.4000 10.0270 10.0270 11.0658 11.0658 11.6234 11.6234 k = 0.0000 0.2778-0.0000 ( 15888 PWs) bands (ev): -69.8717 -69.8717 -69.8661 -69.8661 -39.6480 -39.6480 -39.6364 -39.6364 -38.4891 -38.4891 -38.4694 -38.4694 -38.3895 -38.3895 -38.3869 -38.3869 -19.5780 -19.5780 -19.4481 -19.4481 -15.8547 -15.8547 -15.8382 -15.8382 -6.1891 -6.1891 -6.0467 -6.0467 -4.3504 -4.3504 -4.1980 -4.1980 -4.0514 -4.0514 -4.0072 -4.0072 -0.8001 -0.8001 -0.2812 -0.2812 2.4050 2.4050 2.4250 2.4250 2.4734 2.4734 2.5119 2.5119 2.7761 2.7761 2.9179 2.9179 5.1759 5.1759 5.5520 5.5520 5.9859 5.9859 6.3884 6.3884 6.5507 6.5507 6.8668 6.8668 7.4530 7.4530 8.0203 8.0203 8.2266 8.2266 8.3747 8.3747 8.4523 8.4523 8.4849 8.4849 9.2069 9.2069 9.2865 9.2865 9.4128 9.4128 9.9991 9.9991 11.0476 11.0476 11.6559 11.6559 k = 0.0000 0.2917-0.0000 ( 15878 PWs) bands (ev): -69.8709 -69.8709 -69.8663 -69.8663 -39.6477 -39.6477 -39.6367 -39.6367 -38.4886 -38.4886 -38.4699 -38.4699 -38.3894 -38.3894 -38.3869 -38.3869 -19.5725 -19.5725 -19.4494 -19.4494 -15.8578 -15.8578 -15.8420 -15.8420 -6.1880 -6.1880 -6.0500 -6.0500 -4.3490 -4.3490 -4.1967 -4.1967 -4.0580 -4.0580 -4.0132 -4.0132 -0.7727 -0.7727 -0.2757 -0.2757 2.4139 2.4139 2.4317 2.4317 2.4864 2.4864 2.5162 2.5162 2.7650 2.7650 2.9137 2.9137 5.1687 5.1687 5.4970 5.4970 5.9872 5.9872 6.3917 6.3917 6.5586 6.5586 6.8539 6.8539 7.4797 7.4797 8.0132 8.0132 8.2229 8.2229 8.3699 8.3699 8.4270 8.4270 8.4602 8.4602 9.1844 9.1844 9.3024 9.3024 9.4248 9.4248 9.9715 9.9715 11.0269 11.0269 11.6806 11.6806 k = 0.0000 0.3056-0.0000 ( 15886 PWs) bands (ev): -69.8713 -69.8713 -69.8664 -69.8664 -39.6474 -39.6474 -39.6371 -39.6371 -38.4881 -38.4881 -38.4705 -38.4705 -38.3893 -38.3893 -38.3870 -38.3870 -19.5670 -19.5670 -19.4508 -19.4508 -15.8608 -15.8608 -15.8457 -15.8457 -6.1866 -6.1866 -6.0536 -6.0536 -4.3468 -4.3468 -4.1949 -4.1949 -4.0652 -4.0652 -4.0197 -4.0197 -0.7447 -0.7447 -0.2712 -0.2712 2.4226 2.4226 2.4385 2.4385 2.4997 2.4997 2.5205 2.5205 2.7538 2.7538 2.9086 2.9086 5.1569 5.1569 5.4427 5.4427 5.9954 5.9954 6.3958 6.3958 6.5669 6.5669 6.8408 6.8408 7.5039 7.5039 8.0027 8.0027 8.2167 8.2167 8.3610 8.3610 8.4004 8.4004 8.4337 8.4337 9.1648 9.1648 9.3145 9.3145 9.4377 9.4377 9.9449 9.9449 11.0055 11.0055 11.6966 11.6966 k = 0.0000 0.3194-0.0000 ( 15884 PWs) bands (ev): -69.8710 -69.8710 -69.8666 -69.8666 -39.6470 -39.6470 -39.6374 -39.6374 -38.4875 -38.4875 -38.4711 -38.4711 -38.3893 -38.3893 -38.3871 -38.3871 -19.5613 -19.5613 -19.4524 -19.4524 -15.8637 -15.8637 -15.8494 -15.8494 -6.1847 -6.1847 -6.0575 -6.0575 -4.3439 -4.3439 -4.1928 -4.1928 -4.0732 -4.0732 -4.0264 -4.0264 -0.7161 -0.7161 -0.2676 -0.2676 2.4312 2.4312 2.4455 2.4455 2.5133 2.5133 2.5246 2.5246 2.7425 2.7425 2.9027 2.9027 5.1413 5.1413 5.3899 5.3899 6.0097 6.0097 6.4003 6.4003 6.5751 6.5751 6.8279 6.8279 7.5311 7.5311 7.9972 7.9972 8.2096 8.2096 8.3512 8.3512 8.3740 8.3740 8.4093 8.4093 9.1480 9.1480 9.3264 9.3264 9.4511 9.4511 9.9181 9.9181 10.9853 10.9853 11.7034 11.7034 k = 0.0000 0.3333-0.0000 ( 15882 PWs) bands (ev): -69.8712 -69.8712 -69.8663 -69.8663 -39.6467 -39.6467 -39.6377 -39.6377 -38.4869 -38.4869 -38.4717 -38.4717 -38.3892 -38.3892 -38.3872 -38.3872 -19.5557 -19.5557 -19.4542 -19.4542 -15.8665 -15.8665 -15.8530 -15.8530 -6.1824 -6.1824 -6.0618 -6.0618 -4.3403 -4.3403 -4.1904 -4.1904 -4.0817 -4.0817 -4.0334 -4.0334 -0.6871 -0.6871 -0.2653 -0.2653 2.4395 2.4395 2.4526 2.4526 2.5268 2.5268 2.5290 2.5290 2.7313 2.7313 2.8958 2.8958 5.1231 5.1231 5.3391 5.3391 6.0297 6.0297 6.4053 6.4053 6.5835 6.5835 6.8152 6.8152 7.5566 7.5566 7.9924 7.9924 8.2020 8.2020 8.3378 8.3378 8.3484 8.3484 8.3854 8.3854 9.1368 9.1368 9.3352 9.3352 9.4647 9.4647 9.8920 9.8920 10.9681 10.9681 11.7021 11.7021 k = 0.0000 0.3472-0.0000 ( 15902 PWs) bands (ev): -69.8716 -69.8716 -69.8672 -69.8672 -39.6464 -39.6464 -39.6381 -39.6381 -38.4864 -38.4864 -38.4723 -38.4723 -38.3891 -38.3891 -38.3873 -38.3873 -19.5500 -19.5500 -19.4562 -19.4562 -15.8691 -15.8691 -15.8564 -15.8564 -6.1798 -6.1798 -6.0663 -6.0663 -4.3358 -4.3358 -4.1878 -4.1878 -4.0907 -4.0907 -4.0404 -4.0404 -0.6580 -0.6580 -0.2643 -0.2643 2.4475 2.4475 2.4598 2.4598 2.5324 2.5324 2.5414 2.5414 2.7203 2.7203 2.8879 2.8879 5.1031 5.1031 5.2907 5.2907 6.0533 6.0533 6.4096 6.4096 6.5917 6.5917 6.8020 6.8020 7.5836 7.5836 7.9860 7.9860 8.1917 8.1917 8.3129 8.3129 8.3275 8.3275 8.3621 8.3621 9.1270 9.1270 9.3389 9.3389 9.4753 9.4753 9.8662 9.8662 10.9548 10.9548 11.6916 11.6916 k = 0.0000 0.3611-0.0000 ( 15904 PWs) bands (ev): -69.8717 -69.8717 -69.8671 -69.8671 -39.6460 -39.6460 -39.6385 -39.6385 -38.4858 -38.4858 -38.4729 -38.4729 -38.3891 -38.3891 -38.3874 -38.3874 -19.5444 -19.5444 -19.4584 -19.4584 -15.8714 -15.8714 -15.8597 -15.8597 -6.1767 -6.1767 -6.0712 -6.0712 -4.3306 -4.3306 -4.1852 -4.1852 -4.1001 -4.1001 -4.0474 -4.0474 -0.6287 -0.6287 -0.2648 -0.2648 2.4552 2.4552 2.4670 2.4670 2.5362 2.5362 2.5554 2.5554 2.7096 2.7096 2.8789 2.8789 5.0827 5.0827 5.2451 5.2451 6.0804 6.0804 6.4133 6.4133 6.6002 6.6002 6.7897 6.7897 7.6131 7.6131 7.9808 7.9808 8.1821 8.1821 8.2853 8.2853 8.3116 8.3116 8.3414 8.3414 9.1228 9.1228 9.3392 9.3392 9.4893 9.4893 9.8418 9.8418 10.9468 10.9468 11.6735 11.6735 k = 0.0000 0.3750-0.0000 ( 15898 PWs) bands (ev): -69.8709 -69.8709 -69.8676 -69.8676 -39.6457 -39.6457 -39.6388 -39.6388 -38.4852 -38.4852 -38.4735 -38.4735 -38.3890 -38.3890 -38.3875 -38.3875 -19.5387 -19.5387 -19.4608 -19.4608 -15.8736 -15.8736 -15.8629 -15.8629 -6.1732 -6.1732 -6.0763 -6.0763 -4.3245 -4.3245 -4.1829 -4.1829 -4.1094 -4.1094 -4.0545 -4.0545 -0.5996 -0.5996 -0.2669 -0.2669 2.4625 2.4625 2.4741 2.4741 2.5399 2.5399 2.5694 2.5694 2.6995 2.6995 2.8689 2.8689 5.0625 5.0625 5.2027 5.2027 6.1095 6.1095 6.4161 6.4161 6.6088 6.6088 6.7775 6.7775 7.6460 7.6460 7.9815 7.9815 8.1702 8.1702 8.2567 8.2567 8.2960 8.2960 8.3232 8.3232 9.1212 9.1212 9.3380 9.3380 9.5027 9.5027 9.8184 9.8184 10.9449 10.9449 11.6464 11.6464 k = 0.0000 0.3889-0.0000 ( 15914 PWs) bands (ev): -69.8711 -69.8711 -69.8684 -69.8684 -39.6453 -39.6453 -39.6392 -39.6392 -38.4846 -38.4846 -38.4741 -38.4741 -38.3889 -38.3889 -38.3875 -38.3875 -19.5332 -19.5332 -19.4634 -19.4634 -15.8754 -15.8754 -15.8658 -15.8658 -6.1694 -6.1694 -6.0816 -6.0816 -4.3177 -4.3177 -4.1814 -4.1814 -4.1182 -4.1182 -4.0615 -4.0615 -0.5707 -0.5707 -0.2707 -0.2707 2.4695 2.4695 2.4809 2.4809 2.5435 2.5435 2.5828 2.5828 2.6903 2.6903 2.8579 2.8579 5.0434 5.0434 5.1636 5.1636 6.1395 6.1395 6.4176 6.4176 6.6165 6.6165 6.7656 6.7656 7.6744 7.6744 7.9828 7.9828 8.1550 8.1550 8.2271 8.2271 8.2777 8.2777 8.3022 8.3022 9.1215 9.1215 9.3334 9.3334 9.5158 9.5158 9.7946 9.7946 10.9495 10.9495 11.6106 11.6106 k = 0.0000 0.4028-0.0000 ( 15890 PWs) bands (ev): -69.8697 -69.8697 -69.8684 -69.8684 -39.6450 -39.6450 -39.6395 -39.6395 -38.4840 -38.4840 -38.4747 -38.4747 -38.3888 -38.3888 -38.3876 -38.3876 -19.5276 -19.5276 -19.4663 -19.4663 -15.8771 -15.8771 -15.8685 -15.8685 -6.1652 -6.1652 -6.0871 -6.0871 -4.3101 -4.3101 -4.1813 -4.1813 -4.1257 -4.1257 -4.0685 -4.0685 -0.5422 -0.5422 -0.2763 -0.2763 2.4761 2.4761 2.4872 2.4872 2.5472 2.5472 2.5951 2.5951 2.6828 2.6828 2.8458 2.8458 5.0261 5.0261 5.1282 5.1282 6.1707 6.1707 6.4180 6.4180 6.6248 6.6248 6.7540 6.7540 7.7086 7.7086 7.9881 7.9881 8.1397 8.1397 8.1997 8.1997 8.2701 8.2701 8.2914 8.2914 9.1269 9.1269 9.3262 9.3262 9.5296 9.5296 9.7722 9.7722 10.9612 10.9612 11.5677 11.5677 k = 0.0000 0.4167-0.0000 ( 15902 PWs) bands (ev): -69.8698 -69.8698 -69.8689 -69.8689 -39.6446 -39.6446 -39.6399 -39.6399 -38.4833 -38.4833 -38.4754 -38.4754 -38.3888 -38.3888 -38.3877 -38.3877 -19.5222 -19.5222 -19.4694 -19.4694 -15.8784 -15.8784 -15.8710 -15.8710 -6.1607 -6.1607 -6.0928 -6.0928 -4.3018 -4.3018 -4.1836 -4.1836 -4.1307 -4.1307 -4.0755 -4.0755 -0.5143 -0.5143 -0.2839 -0.2839 2.4823 2.4823 2.4929 2.4929 2.5512 2.5512 2.6048 2.6048 2.6784 2.6784 2.8328 2.8328 5.0109 5.0109 5.0963 5.0963 6.2014 6.2014 6.4161 6.4161 6.6326 6.6326 6.7420 6.7420 7.7392 7.7392 7.9897 7.9897 8.1196 8.1196 8.1726 8.1726 8.2572 8.2572 8.2756 8.2756 9.1340 9.1340 9.3143 9.3143 9.5421 9.5421 9.7506 9.7506 10.9789 10.9789 11.5191 11.5191 k = 0.0000 0.4306-0.0000 ( 15902 PWs) bands (ev): -69.8700 -69.8700 -69.8688 -69.8688 -39.6442 -39.6442 -39.6403 -39.6403 -38.4827 -38.4827 -38.4760 -38.4760 -38.3887 -38.3887 -38.3878 -38.3878 -19.5169 -19.5169 -19.4727 -19.4727 -15.8795 -15.8795 -15.8732 -15.8732 -6.1559 -6.1559 -6.0987 -6.0987 -4.2928 -4.2928 -4.1889 -4.1889 -4.1327 -4.1327 -4.0823 -4.0823 -0.4873 -0.4873 -0.2933 -0.2933 2.4880 2.4880 2.4978 2.4978 2.5554 2.5554 2.6102 2.6102 2.6789 2.6789 2.8189 2.8189 4.9985 4.9985 5.0682 5.0682 6.2316 6.2316 6.4125 6.4125 6.6404 6.6404 6.7307 6.7307 7.7701 7.7701 7.9935 7.9935 8.0980 8.0980 8.1504 8.1504 8.2464 8.2464 8.2625 8.2625 9.1441 9.1441 9.3011 9.3011 9.5563 9.5563 9.7296 9.7296 11.0032 11.0032 11.4670 11.4670 k = 0.0000 0.4444-0.0000 ( 15906 PWs) bands (ev): -69.8705 -69.8705 -69.8685 -69.8685 -39.6438 -39.6438 -39.6407 -39.6407 -38.4820 -38.4820 -38.4767 -38.4767 -38.3886 -38.3886 -38.3879 -38.3879 -19.5117 -19.5117 -19.4762 -19.4762 -15.8803 -15.8803 -15.8752 -15.8752 -6.1508 -6.1508 -6.1046 -6.1046 -4.2832 -4.2832 -4.1969 -4.1969 -4.1319 -4.1319 -4.0891 -4.0891 -0.4612 -0.4612 -0.3047 -0.3047 2.4931 2.4931 2.5018 2.5018 2.5602 2.5602 2.6102 2.6102 2.6853 2.6853 2.8042 2.8042 4.9891 4.9891 5.0440 5.0440 6.2604 6.2604 6.4066 6.4066 6.6475 6.6475 6.7200 6.7200 7.7983 7.7983 7.9971 7.9971 8.0755 8.0755 8.1305 8.1305 8.2373 8.2373 8.2530 8.2530 9.1555 9.1555 9.2861 9.2861 9.5711 9.5711 9.7084 9.7084 11.0333 11.0333 11.4131 11.4131 k = 0.0000 0.4583-0.0000 ( 15918 PWs) bands (ev): -69.8704 -69.8704 -69.8693 -69.8693 -39.6434 -39.6434 -39.6411 -39.6411 -38.4814 -38.4814 -38.4774 -38.4774 -38.3885 -38.3885 -38.3880 -38.3880 -19.5066 -19.5066 -19.4799 -19.4799 -15.8807 -15.8807 -15.8769 -15.8769 -6.1455 -6.1455 -6.1106 -6.1106 -4.2731 -4.2731 -4.2067 -4.2067 -4.1290 -4.1290 -4.0957 -4.0957 -0.4362 -0.4362 -0.3182 -0.3182 2.4975 2.4975 2.5045 2.5045 2.5656 2.5656 2.6062 2.6062 2.6962 2.6962 2.7889 2.7889 4.9829 4.9829 5.0236 5.0236 6.2872 6.2872 6.3977 6.3977 6.6550 6.6550 6.7095 6.7095 7.8299 7.8299 7.9936 7.9936 8.0564 8.0564 8.1107 8.1107 8.2308 8.2308 8.2422 8.2422 9.1680 9.1680 9.2694 9.2694 9.5858 9.5858 9.6879 9.6879 11.0686 11.0686 11.3582 11.3582 k = 0.0000 0.4722-0.0000 ( 15920 PWs) bands (ev): -69.8700 -69.8700 -69.8699 -69.8699 -39.6431 -39.6431 -39.6415 -39.6415 -38.4807 -38.4807 -38.4781 -38.4781 -38.3884 -38.3884 -38.3881 -38.3881 -19.5017 -19.5017 -19.4839 -19.4839 -15.8809 -15.8809 -15.8783 -15.8783 -6.1400 -6.1400 -6.1166 -6.1166 -4.2624 -4.2624 -4.2175 -4.2175 -4.1249 -4.1249 -4.1022 -4.1022 -0.4125 -0.4125 -0.3335 -0.3335 2.5011 2.5011 2.5061 2.5061 2.5717 2.5717 2.6000 2.6000 2.7099 2.7099 2.7731 2.7731 4.9802 4.9802 5.0072 5.0072 6.3121 6.3121 6.3860 6.3860 6.6632 6.6632 6.7001 6.7001 7.8631 7.8631 7.9799 7.9799 8.0497 8.0497 8.0923 8.0923 8.2270 8.2270 8.2342 8.2342 9.1824 9.1824 9.2517 9.2517 9.6024 9.6024 9.6693 9.6693 11.1087 11.1087 11.3037 11.3037 k = 0.0000 0.4861-0.0000 ( 15916 PWs) bands (ev): -69.8700 -69.8700 -69.8697 -69.8697 -39.6427 -39.6427 -39.6419 -39.6419 -38.4801 -38.4801 -38.4787 -38.4787 -38.3884 -38.3884 -38.3882 -38.3882 -19.4970 -19.4970 -19.4881 -19.4881 -15.8807 -15.8807 -15.8794 -15.8794 -6.1343 -6.1343 -6.1225 -6.1225 -4.2514 -4.2514 -4.2287 -4.2287 -4.1199 -4.1199 -4.1084 -4.1084 -0.3903 -0.3903 -0.3507 -0.3507 2.5039 2.5039 2.5065 2.5065 2.5784 2.5784 2.5929 2.5929 2.7251 2.7251 2.7570 2.7570 4.9812 4.9812 4.9947 4.9947 6.3344 6.3344 6.3716 6.3716 6.6726 6.6726 6.6907 6.6907 7.8969 7.8969 7.9560 7.9560 8.0548 8.0548 8.0766 8.0766 8.2258 8.2258 8.2288 8.2288 9.1979 9.1979 9.2337 9.2337 9.6189 9.6189 9.6528 9.6528 11.1531 11.1531 11.2511 11.2511 k = 0.0000 0.5000-0.0000 ( 15916 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2401 -4.2401 -4.2401 -4.2401 -4.1144 -4.1144 -4.1144 -4.1144 -0.3696 -0.3696 -0.3696 -0.3696 2.5057 2.5057 2.5057 2.5057 2.5856 2.5856 2.5856 2.5856 2.7409 2.7409 2.7409 2.7409 4.9860 4.9860 4.9860 4.9860 6.3545 6.3545 6.3545 6.3545 6.6810 6.6810 6.6810 6.6810 7.9261 7.9261 7.9261 7.9261 8.0650 8.0650 8.0650 8.0650 8.2274 8.2274 8.2274 8.2274 9.2158 9.2158 9.2158 9.2158 9.6349 9.6349 9.6349 9.6349 11.2008 11.2008 11.2008 11.2008 k = 0.0000 0.5000-0.0000 ( 15916 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2401 -4.2401 -4.2401 -4.2401 -4.1144 -4.1144 -4.1144 -4.1144 -0.3696 -0.3696 -0.3696 -0.3696 2.5057 2.5057 2.5057 2.5057 2.5856 2.5856 2.5856 2.5856 2.7409 2.7409 2.7409 2.7409 4.9860 4.9860 4.9860 4.9860 6.3545 6.3545 6.3545 6.3545 6.6810 6.6810 6.6810 6.6810 7.9261 7.9261 7.9261 7.9261 8.0650 8.0650 8.0650 8.0650 8.2274 8.2274 8.2274 8.2274 9.2158 9.2158 9.2158 9.2158 9.6349 9.6349 9.6349 9.6349 11.2008 11.2008 11.2008 11.2008 k = 0.0139 0.5000-0.0000 ( 15918 PWs) bands (ev): -69.8699 -69.8699 -69.8699 -69.8699 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3883 -38.3883 -38.3882 -38.3882 -19.4923 -19.4923 -19.4923 -19.4923 -15.8805 -15.8805 -15.8803 -15.8803 -6.1332 -6.1332 -6.1238 -6.1238 -4.2416 -4.2416 -4.2391 -4.2391 -4.1223 -4.1223 -4.1061 -4.1061 -0.3694 -0.3694 -0.3692 -0.3692 2.5035 2.5035 2.5084 2.5084 2.5772 2.5772 2.5918 2.5918 2.7342 2.7342 2.7503 2.7503 4.9855 4.9855 4.9865 4.9865 6.3497 6.3497 6.3594 6.3594 6.6780 6.6780 6.6821 6.6821 7.9206 7.9206 7.9276 7.9276 8.0598 8.0598 8.0718 8.0718 8.2253 8.2253 8.2280 8.2280 9.2081 9.2081 9.2137 9.2137 9.6306 9.6306 9.6435 9.6435 11.2011 11.2011 11.2020 11.2020 k = 0.0278 0.5000-0.0000 ( 15930 PWs) bands (ev): -69.8702 -69.8702 -69.8702 -69.8702 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3883 -38.3883 -38.3883 -38.3883 -19.4920 -19.4920 -19.4920 -19.4920 -15.8810 -15.8810 -15.8806 -15.8806 -6.1380 -6.1380 -6.1193 -6.1193 -4.2435 -4.2435 -4.2388 -4.2388 -4.1295 -4.1295 -4.0976 -4.0976 -0.3685 -0.3685 -0.3682 -0.3682 2.5014 2.5014 2.5116 2.5116 2.5679 2.5679 2.5951 2.5951 2.7309 2.7309 2.7615 2.7615 4.9847 4.9847 4.9868 4.9868 6.3447 6.3447 6.3644 6.3644 6.6719 6.6719 6.6806 6.6806 7.9088 7.9088 7.9215 7.9215 8.0580 8.0580 8.0806 8.0806 8.2230 8.2230 8.2284 8.2284 9.1920 9.1920 9.2019 9.2019 9.6293 9.6293 9.6538 9.6538 11.2032 11.2032 11.2048 11.2048 k = 0.0417 0.5000-0.0000 ( 15926 PWs) bands (ev): -69.8701 -69.8701 -69.8701 -69.8701 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4916 -19.4916 -19.4916 -19.4916 -15.8819 -15.8819 -15.8813 -15.8813 -6.1427 -6.1427 -6.1149 -6.1149 -4.2454 -4.2454 -4.2394 -4.2394 -4.1358 -4.1358 -4.0892 -4.0892 -0.3669 -0.3669 -0.3665 -0.3665 2.4991 2.4991 2.5154 2.5154 2.5586 2.5586 2.5946 2.5946 2.7316 2.7316 2.7738 2.7738 4.9839 4.9839 4.9871 4.9871 6.3403 6.3403 6.3701 6.3701 6.6647 6.6647 6.6780 6.6780 7.8958 7.8958 7.9121 7.9121 8.0592 8.0592 8.0901 8.0901 8.2221 8.2221 8.2299 8.2299 9.1701 9.1701 9.1829 9.1829 9.6330 9.6330 9.6669 9.6669 11.2069 11.2069 11.2087 11.2087 k = 0.0556 0.5000-0.0000 ( 15914 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4909 -19.4909 -19.4909 -19.4909 -15.8831 -15.8831 -15.8823 -15.8823 -6.1475 -6.1475 -6.1106 -6.1106 -4.2475 -4.2475 -4.2411 -4.2411 -4.1409 -4.1409 -4.0810 -4.0810 -0.3647 -0.3647 -0.3641 -0.3641 2.4961 2.4961 2.5199 2.5199 2.5504 2.5504 2.5906 2.5906 2.7361 2.7361 2.7868 2.7868 4.9829 4.9829 4.9873 4.9873 6.3361 6.3361 6.3767 6.3767 6.6553 6.6553 6.6740 6.6740 7.8819 7.8819 7.9002 7.9002 8.0618 8.0618 8.0986 8.0986 8.2228 8.2228 8.2325 8.2325 9.1442 9.1442 9.1580 9.1580 9.6391 9.6391 9.6801 9.6801 11.2117 11.2117 11.2131 11.2131 k = 0.0694 0.5000-0.0000 ( 15914 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6423 -39.6423 -39.6423 -39.6423 -38.4795 -38.4795 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4900 -19.4900 -19.4900 -19.4900 -15.8845 -15.8845 -15.8835 -15.8835 -6.1522 -6.1522 -6.1066 -6.1066 -4.2494 -4.2494 -4.2441 -4.2441 -4.1446 -4.1446 -4.0731 -4.0731 -0.3619 -0.3619 -0.3611 -0.3611 2.4915 2.4915 2.5251 2.5251 2.5444 2.5444 2.5837 2.5837 2.7437 2.7437 2.8001 2.8001 4.9816 4.9816 4.9873 4.9873 6.3312 6.3312 6.3832 6.3832 6.6434 6.6434 6.6681 6.6681 7.8655 7.8655 7.8845 7.8845 8.0625 8.0625 8.1026 8.1026 8.2248 8.2248 8.2353 8.2353 9.1144 9.1144 9.1279 9.1279 9.6454 9.6454 9.6910 9.6910 11.2169 11.2169 11.2172 11.2172 k = 0.0833 0.5000-0.0000 ( 15930 PWs) bands (ev): -69.8702 -69.8702 -69.8702 -69.8702 -39.6423 -39.6423 -39.6423 -39.6423 -38.4795 -38.4795 -38.4795 -38.4795 -38.3882 -38.3882 -38.3882 -38.3882 -19.4890 -19.4890 -19.4890 -19.4890 -15.8863 -15.8863 -15.8851 -15.8851 -6.1568 -6.1568 -6.1029 -6.1029 -4.2513 -4.2513 -4.2485 -4.2485 -4.1468 -4.1468 -4.0657 -4.0657 -0.3584 -0.3584 -0.3576 -0.3576 2.4850 2.4850 2.5310 2.5310 2.5412 2.5412 2.5748 2.5748 2.7534 2.7534 2.8136 2.8136 4.9798 4.9798 4.9869 4.9869 6.3253 6.3253 6.3897 6.3897 6.6287 6.6287 6.6602 6.6602 7.8470 7.8470 7.8662 7.8662 8.0591 8.0591 8.1006 8.1006 8.2296 8.2296 8.2394 8.2394 9.0815 9.0815 9.0937 9.0937 9.6494 9.6494 9.6978 9.6978 11.2206 11.2206 11.2220 11.2220 k = 0.0972 0.5000-0.0000 ( 15914 PWs) bands (ev): -69.8697 -69.8697 -69.8697 -69.8697 -39.6423 -39.6423 -39.6423 -39.6423 -38.4795 -38.4795 -38.4795 -38.4795 -38.3882 -38.3882 -38.3881 -38.3881 -19.4878 -19.4878 -19.4878 -19.4878 -15.8883 -15.8883 -15.8869 -15.8869 -6.1613 -6.1613 -6.0994 -6.0994 -4.2539 -4.2539 -4.2531 -4.2531 -4.1477 -4.1477 -4.0588 -4.0588 -0.3544 -0.3544 -0.3534 -0.3534 2.4768 2.4768 2.5376 2.5376 2.5408 2.5408 2.5645 2.5645 2.7646 2.7646 2.8269 2.8269 4.9778 4.9778 4.9864 4.9864 6.3193 6.3193 6.3973 6.3973 6.6136 6.6136 6.6532 6.6532 7.8318 7.8318 7.8510 7.8510 8.0547 8.0547 8.0956 8.0956 8.2392 8.2392 8.2469 8.2469 9.0501 9.0501 9.0602 9.0602 9.6546 9.6546 9.7041 9.7041 11.2233 11.2233 11.2269 11.2269 k = 0.1111 0.5000-0.0000 ( 15922 PWs) bands (ev): -69.8700 -69.8700 -69.8700 -69.8700 -39.6423 -39.6423 -39.6423 -39.6423 -38.4796 -38.4796 -38.4795 -38.4795 -38.3881 -38.3881 -38.3881 -38.3881 -19.4864 -19.4864 -19.4864 -19.4864 -15.8905 -15.8905 -15.8890 -15.8890 -6.1656 -6.1656 -6.0961 -6.0961 -4.2603 -4.2603 -4.2546 -4.2546 -4.1474 -4.1474 -4.0526 -4.0526 -0.3498 -0.3498 -0.3487 -0.3487 2.4675 2.4675 2.5427 2.5427 2.5450 2.5450 2.5536 2.5536 2.7765 2.7765 2.8400 2.8400 4.9751 4.9751 4.9854 4.9854 6.3116 6.3116 6.4046 6.4046 6.5957 6.5957 6.6450 6.6450 7.8130 7.8130 7.8321 7.8321 8.0452 8.0452 8.0847 8.0847 8.2511 8.2511 8.2561 8.2561 9.0173 9.0173 9.0251 9.0251 9.6547 9.6547 9.7041 9.7041 11.2249 11.2249 11.2311 11.2311 k = 0.1250 0.5000-0.0000 ( 15922 PWs) bands (ev): -69.8700 -69.8700 -69.8700 -69.8700 -39.6424 -39.6424 -39.6423 -39.6423 -38.4796 -38.4796 -38.4796 -38.4796 -38.3881 -38.3881 -38.3881 -38.3881 -19.4849 -19.4849 -19.4849 -19.4849 -15.8930 -15.8930 -15.8914 -15.8914 -6.1697 -6.1697 -6.0932 -6.0932 -4.2673 -4.2673 -4.2559 -4.2559 -4.1462 -4.1462 -4.0471 -4.0471 -0.3447 -0.3447 -0.3435 -0.3435 2.4578 2.4578 2.5422 2.5422 2.5464 2.5464 2.5531 2.5531 2.7889 2.7889 2.8527 2.8527 4.9718 4.9718 4.9840 4.9840 6.3031 6.3031 6.4124 6.4124 6.5767 6.5767 6.6373 6.6373 7.7953 7.7953 7.8141 7.8141 8.0334 8.0334 8.0703 8.0703 8.2645 8.2645 8.2663 8.2663 8.9856 8.9856 8.9910 8.9910 9.6532 9.6532 9.7012 9.7012 11.2260 11.2260 11.2349 11.2349 k = 0.1389 0.5000-0.0000 ( 15916 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6424 -39.6424 -39.6423 -39.6423 -38.4796 -38.4796 -38.4796 -38.4796 -38.3881 -38.3881 -38.3880 -38.3880 -19.4832 -19.4832 -19.4832 -19.4832 -15.8957 -15.8957 -15.8939 -15.8939 -6.1735 -6.1735 -6.0907 -6.0907 -4.2747 -4.2747 -4.2570 -4.2570 -4.1443 -4.1443 -4.0423 -4.0423 -0.3390 -0.3390 -0.3378 -0.3378 2.4481 2.4481 2.5310 2.5310 2.5516 2.5516 2.5618 2.5618 2.8012 2.8012 2.8650 2.8650 4.9679 4.9679 4.9820 4.9820 6.2937 6.2937 6.4210 6.4210 6.5566 6.5566 6.6300 6.6300 7.7788 7.7788 7.7969 7.7969 8.0199 8.0199 8.0537 8.0537 8.2766 8.2766 8.2778 8.2778 8.9553 8.9553 8.9584 8.9584 9.6497 9.6497 9.6954 9.6954 11.2268 11.2268 11.2384 11.2384 k = 0.1528 0.5000-0.0000 ( 15928 PWs) bands (ev): -69.8701 -69.8701 -69.8701 -69.8701 -39.6424 -39.6424 -39.6423 -39.6423 -38.4797 -38.4797 -38.4796 -38.4796 -38.3880 -38.3880 -38.3880 -38.3880 -19.4815 -19.4815 -19.4815 -19.4815 -15.8987 -15.8987 -15.8967 -15.8967 -6.1772 -6.1772 -6.0884 -6.0884 -4.2822 -4.2822 -4.2578 -4.2578 -4.1420 -4.1420 -4.0384 -4.0384 -0.3329 -0.3329 -0.3316 -0.3316 2.4386 2.4386 2.5198 2.5198 2.5580 2.5580 2.5712 2.5712 2.8135 2.8135 2.8767 2.8767 4.9630 4.9630 4.9791 4.9791 6.2821 6.2821 6.4286 6.4286 6.5353 6.5353 6.6229 6.6229 7.7614 7.7614 7.7791 7.7791 8.0025 8.0025 8.0337 8.0337 8.2865 8.2865 8.2905 8.2905 8.9252 8.9252 8.9261 8.9261 9.6414 9.6414 9.6843 9.6843 11.2268 11.2268 11.2410 11.2410 k = 0.1667 0.5000-0.0000 ( 15920 PWs) bands (ev): -69.8699 -69.8699 -69.8699 -69.8699 -39.6424 -39.6424 -39.6423 -39.6423 -38.4797 -38.4797 -38.4797 -38.4797 -38.3880 -38.3880 -38.3880 -38.3880 -19.4796 -19.4796 -19.4795 -19.4795 -15.9017 -15.9017 -15.8997 -15.8997 -6.1805 -6.1805 -6.0866 -6.0866 -4.2896 -4.2896 -4.2584 -4.2584 -4.1392 -4.1392 -4.0353 -4.0353 -0.3264 -0.3264 -0.3250 -0.3250 2.4296 2.4296 2.5090 2.5090 2.5653 2.5653 2.5812 2.5812 2.8254 2.8254 2.8878 2.8878 4.9573 4.9573 4.9755 4.9755 6.2702 6.2702 6.4366 6.4366 6.5149 6.5149 6.6175 6.6175 7.7458 7.7458 7.7629 7.7629 7.9833 7.9833 8.0117 8.0117 8.2986 8.2986 8.3052 8.3052 8.8966 8.8966 8.8978 8.8978 9.6334 9.6334 9.6728 9.6728 11.2263 11.2263 11.2430 11.2430 k = 0.1806 0.5000-0.0000 ( 15934 PWs) bands (ev): -69.8703 -69.8703 -69.8703 -69.8703 -39.6424 -39.6424 -39.6423 -39.6423 -38.4798 -38.4798 -38.4797 -38.4797 -38.3880 -38.3880 -38.3879 -38.3879 -19.4775 -19.4775 -19.4775 -19.4775 -15.9050 -15.9050 -15.9028 -15.9028 -6.1835 -6.1835 -6.0851 -6.0851 -4.2968 -4.2968 -4.2588 -4.2588 -4.1363 -4.1363 -4.0330 -4.0330 -0.3195 -0.3195 -0.3181 -0.3181 2.4211 2.4211 2.4985 2.4985 2.5737 2.5737 2.5918 2.5918 2.8369 2.8369 2.8983 2.8983 4.9506 4.9506 4.9710 4.9710 6.2564 6.2564 6.4432 6.4432 6.4942 6.4942 6.6128 6.6128 7.7288 7.7288 7.7450 7.7450 7.9603 7.9603 7.9854 7.9854 8.3093 8.3093 8.3186 8.3186 8.8681 8.8681 8.8710 8.8710 9.6203 9.6203 9.6561 9.6561 11.2251 11.2251 11.2441 11.2441 k = 0.1944 0.5000-0.0000 ( 15930 PWs) bands (ev): -69.8702 -69.8702 -69.8702 -69.8702 -39.6424 -39.6424 -39.6423 -39.6423 -38.4798 -38.4798 -38.4798 -38.4798 -38.3879 -38.3879 -38.3879 -38.3879 -19.4755 -19.4755 -19.4755 -19.4755 -15.9083 -15.9083 -15.9061 -15.9061 -6.1862 -6.1862 -6.0841 -6.0841 -4.3037 -4.3037 -4.2590 -4.2590 -4.1333 -4.1333 -4.0316 -4.0316 -0.3123 -0.3123 -0.3108 -0.3108 2.4133 2.4133 2.4885 2.4885 2.5828 2.5828 2.6030 2.6030 2.8478 2.8478 2.9081 2.9081 4.9428 4.9428 4.9653 4.9653 6.2424 6.2424 6.4467 6.4467 6.4778 6.4778 6.6099 6.6099 7.7130 7.7130 7.7283 7.7283 7.9380 7.9380 7.9598 7.9598 8.3210 8.3210 8.3328 8.3328 8.8432 8.8432 8.8479 8.8479 9.6067 9.6067 9.6384 9.6384 11.2236 11.2236 11.2448 11.2448 k = 0.2083 0.5000-0.0000 ( 15926 PWs) bands (ev): -69.8701 -69.8701 -69.8701 -69.8701 -39.6424 -39.6424 -39.6424 -39.6424 -38.4799 -38.4799 -38.4798 -38.4798 -38.3879 -38.3879 -38.3878 -38.3878 -19.4733 -19.4733 -19.4733 -19.4733 -15.9118 -15.9118 -15.9095 -15.9095 -6.1885 -6.1885 -6.0834 -6.0834 -4.3101 -4.3101 -4.2589 -4.2589 -4.1303 -4.1303 -4.0310 -4.0310 -0.3047 -0.3047 -0.3033 -0.3033 2.4062 2.4062 2.4790 2.4790 2.5927 2.5927 2.6147 2.6147 2.8582 2.8582 2.9172 2.9172 4.9339 4.9339 4.9584 4.9584 6.2277 6.2277 6.4387 6.4387 6.4728 6.4728 6.6078 6.6078 7.6985 7.6985 7.7132 7.7132 7.9153 7.9153 7.9342 7.9342 8.3314 8.3314 8.3455 8.3455 8.8188 8.8188 8.8249 8.8249 9.5917 9.5917 9.6195 9.6195 11.2215 11.2215 11.2446 11.2446 k = 0.2222 0.5000-0.0000 ( 15938 PWs) bands (ev): -69.8704 -69.8704 -69.8704 -69.8704 -39.6425 -39.6425 -39.6424 -39.6424 -38.4799 -38.4799 -38.4799 -38.4799 -38.3879 -38.3879 -38.3878 -38.3878 -19.4711 -19.4711 -19.4711 -19.4711 -15.9153 -15.9153 -15.9130 -15.9130 -6.1904 -6.1904 -6.0832 -6.0832 -4.3159 -4.3159 -4.2587 -4.2587 -4.1273 -4.1273 -4.0313 -4.0313 -0.2970 -0.2970 -0.2956 -0.2956 2.3998 2.3998 2.4700 2.4700 2.6033 2.6033 2.6269 2.6269 2.8680 2.8680 2.9255 2.9255 4.9238 4.9238 4.9502 4.9502 6.2126 6.2126 6.4212 6.4212 6.4767 6.4767 6.6062 6.6062 7.6832 7.6832 7.6975 7.6975 7.8914 7.8914 7.9079 7.9079 8.3406 8.3406 8.3567 8.3567 8.7945 8.7945 8.8018 8.8018 9.5730 9.5730 9.5969 9.5969 11.2185 11.2185 11.2435 11.2435 k = 0.2361 0.5000-0.0000 ( 15926 PWs) bands (ev): -69.8701 -69.8701 -69.8701 -69.8701 -39.6425 -39.6425 -39.6424 -39.6424 -38.4800 -38.4800 -38.4799 -38.4799 -38.3878 -38.3878 -38.3877 -38.3877 -19.4688 -19.4688 -19.4688 -19.4688 -15.9189 -15.9189 -15.9166 -15.9166 -6.1919 -6.1919 -6.0833 -6.0833 -4.3212 -4.3212 -4.2583 -4.2583 -4.1244 -4.1244 -4.0323 -4.0323 -0.2891 -0.2891 -0.2877 -0.2877 2.3941 2.3941 2.4616 2.4616 2.6146 2.6146 2.6396 2.6396 2.8770 2.8770 2.9330 2.9330 4.9126 4.9126 4.9407 4.9407 6.1985 6.1985 6.4026 6.4026 6.4832 6.4832 6.6057 6.6057 7.6715 7.6715 7.6854 7.6854 7.8691 7.8691 7.8830 7.8830 8.3505 8.3505 8.3686 8.3686 8.7728 8.7728 8.7813 8.7813 9.5549 9.5549 9.5750 9.5750 11.2158 11.2158 11.2424 11.2424 k = 0.2500 0.5000-0.0000 ( 15942 PWs) bands (ev): -69.8706 -69.8706 -69.8706 -69.8706 -39.6425 -39.6425 -39.6424 -39.6424 -38.4800 -38.4800 -38.4800 -38.4800 -38.3878 -38.3878 -38.3877 -38.3877 -19.4665 -19.4665 -19.4665 -19.4665 -15.9225 -15.9225 -15.9202 -15.9202 -6.1931 -6.1931 -6.0839 -6.0839 -4.3258 -4.3258 -4.2579 -4.2579 -4.1216 -4.1216 -4.0341 -4.0341 -0.2811 -0.2811 -0.2798 -0.2798 2.3891 2.3891 2.4537 2.4537 2.6264 2.6264 2.6525 2.6525 2.8854 2.8854 2.9398 2.9398 4.9001 4.9001 4.9297 4.9297 6.1846 6.1846 6.3836 6.3836 6.4900 6.4900 6.6056 6.6056 7.6578 7.6578 7.6712 7.6712 7.8453 7.8453 7.8567 7.8567 8.3567 8.3567 8.3767 8.3767 8.7498 8.7498 8.7593 8.7593 9.5344 9.5344 9.5510 9.5510 11.2121 11.2121 11.2402 11.2402 k = 0.2639 0.5000-0.0000 ( 15944 PWs) bands (ev): -69.8706 -69.8706 -69.8706 -69.8706 -39.6425 -39.6425 -39.6424 -39.6424 -38.4801 -38.4801 -38.4800 -38.4800 -38.3877 -38.3877 -38.3877 -38.3877 -19.4643 -19.4643 -19.4642 -19.4642 -15.9262 -15.9262 -15.9238 -15.9238 -6.1938 -6.1938 -6.0849 -6.0849 -4.3296 -4.3296 -4.2574 -4.2574 -4.1190 -4.1190 -4.0366 -4.0366 -0.2731 -0.2731 -0.2718 -0.2718 2.3848 2.3848 2.4464 2.4464 2.6388 2.6388 2.6658 2.6658 2.8931 2.8931 2.9458 2.9458 4.8869 4.8869 4.9176 4.9176 6.1721 6.1721 6.3657 6.3657 6.4970 6.4970 6.6060 6.6060 7.6475 7.6475 7.6603 7.6603 7.8228 7.8228 7.8318 7.8318 8.3621 8.3621 8.3839 8.3839 8.7274 8.7274 8.7378 8.7378 9.5160 9.5160 9.5294 9.5294 11.2089 11.2089 11.2381 11.2381 k = 0.2778 0.5000-0.0000 ( 15940 PWs) bands (ev): -69.8705 -69.8705 -69.8705 -69.8705 -39.6425 -39.6425 -39.6424 -39.6424 -38.4801 -38.4801 -38.4801 -38.4801 -38.3877 -38.3877 -38.3876 -38.3876 -19.4620 -19.4620 -19.4620 -19.4620 -15.9297 -15.9297 -15.9274 -15.9274 -6.1941 -6.1941 -6.0863 -6.0863 -4.3327 -4.3327 -4.2569 -4.2569 -4.1166 -4.1166 -4.0397 -4.0397 -0.2650 -0.2650 -0.2637 -0.2637 2.3811 2.3811 2.4396 2.4396 2.6515 2.6515 2.6793 2.6793 2.9000 2.9000 2.9510 2.9510 4.8730 4.8730 4.9045 4.9045 6.1610 6.1610 6.3489 6.3489 6.5037 6.5037 6.6064 6.6064 7.6397 7.6397 7.6516 7.6516 7.8010 7.8010 7.8078 7.8078 8.3663 8.3663 8.3897 8.3897 8.7052 8.7052 8.7163 8.7163 9.4989 9.4989 9.5094 9.5094 11.2065 11.2065 11.2366 11.2366 k = 0.2917 0.5000-0.0000 ( 15940 PWs) bands (ev): -69.8705 -69.8705 -69.8705 -69.8705 -39.6425 -39.6425 -39.6425 -39.6425 -38.4802 -38.4802 -38.4801 -38.4801 -38.3876 -38.3876 -38.3876 -38.3876 -19.4597 -19.4597 -19.4597 -19.4597 -15.9333 -15.9333 -15.9310 -15.9310 -6.1939 -6.1939 -6.0881 -6.0881 -4.3351 -4.3351 -4.2564 -4.2564 -4.1144 -4.1144 -4.0433 -4.0433 -0.2570 -0.2570 -0.2558 -0.2558 2.3781 2.3781 2.4333 2.4333 2.6646 2.6646 2.6929 2.6929 2.9062 2.9062 2.9554 2.9554 4.8583 4.8583 4.8902 4.8902 6.1515 6.1515 6.3332 6.3332 6.5100 6.5100 6.6068 6.6068 7.6314 7.6314 7.6427 7.6427 7.7793 7.7793 7.7840 7.7840 8.3696 8.3696 8.3945 8.3945 8.6835 8.6835 8.6955 8.6955 9.4833 9.4833 9.4913 9.4913 11.2042 11.2042 11.2349 11.2349 k = 0.3056 0.5000-0.0000 ( 15940 PWs) bands (ev): -69.8705 -69.8705 -69.8705 -69.8705 -39.6426 -39.6426 -39.6425 -39.6425 -38.4802 -38.4802 -38.4802 -38.4802 -38.3876 -38.3876 -38.3875 -38.3875 -19.4575 -19.4575 -19.4575 -19.4575 -15.9367 -15.9367 -15.9345 -15.9345 -6.1933 -6.1933 -6.0903 -6.0903 -4.3367 -4.3367 -4.2561 -4.2561 -4.1123 -4.1123 -4.0474 -4.0474 -0.2492 -0.2492 -0.2481 -0.2481 2.3756 2.3756 2.4275 2.4275 2.6779 2.6779 2.7065 2.7065 2.9117 2.9117 2.9591 2.9591 4.8429 4.8429 4.8748 4.8748 6.1436 6.1436 6.3187 6.3187 6.5162 6.5162 6.6077 6.6077 7.6243 7.6243 7.6348 7.6348 7.7594 7.7594 7.7620 7.7620 8.3719 8.3719 8.3983 8.3983 8.6631 8.6631 8.6758 8.6758 9.4659 9.4659 9.4717 9.4717 11.2027 11.2027 11.2339 11.2339 k = 0.3194 0.5000-0.0000 ( 15944 PWs) bands (ev): -69.8706 -69.8706 -69.8706 -69.8706 -39.6426 -39.6426 -39.6425 -39.6425 -38.4803 -38.4803 -38.4802 -38.4802 -38.3875 -38.3875 -38.3875 -38.3875 -19.4554 -19.4554 -19.4554 -19.4554 -15.9400 -15.9400 -15.9379 -15.9379 -6.1923 -6.1923 -6.0929 -6.0929 -4.3375 -4.3375 -4.2560 -4.2560 -4.1105 -4.1105 -4.0518 -4.0518 -0.2415 -0.2415 -0.2405 -0.2405 2.3737 2.3737 2.4222 2.4222 2.6913 2.6913 2.7201 2.7201 2.9164 2.9164 2.9619 2.9619 4.8272 4.8272 4.8586 4.8586 6.1374 6.1374 6.3052 6.3052 6.5218 6.5218 6.6081 6.6081 7.6179 7.6179 7.6279 7.6279 7.7407 7.7407 7.7417 7.7417 8.3722 8.3722 8.4000 8.4000 8.6431 8.6431 8.6565 8.6565 9.4488 9.4488 9.4528 9.4528 11.2022 11.2022 11.2334 11.2334 k = 0.3333 0.5000-0.0000 ( 15934 PWs) bands (ev): -69.8703 -69.8703 -69.8703 -69.8703 -39.6426 -39.6426 -39.6425 -39.6425 -38.4803 -38.4803 -38.4803 -38.4803 -38.3875 -38.3875 -38.3875 -38.3875 -19.4534 -19.4534 -19.4534 -19.4534 -15.9432 -15.9432 -15.9412 -15.9412 -6.1909 -6.1909 -6.0958 -6.0958 -4.3376 -4.3376 -4.2561 -4.2561 -4.1089 -4.1089 -4.0564 -4.0564 -0.2342 -0.2342 -0.2332 -0.2332 2.3723 2.3723 2.4173 2.4173 2.7048 2.7048 2.7336 2.7336 2.9205 2.9205 2.9641 2.9641 4.8117 4.8117 4.8423 4.8423 6.1332 6.1332 6.2929 6.2929 6.5275 6.5275 6.6086 6.6086 7.6135 7.6135 7.6227 7.6227 7.7229 7.7229 7.7237 7.7237 8.3715 8.3715 8.4004 8.4004 8.6238 8.6238 8.6377 8.6377 9.4374 9.4374 9.4399 9.4399 11.2032 11.2032 11.2342 11.2342 k = 0.3472 0.5000-0.0000 ( 15932 PWs) bands (ev): -69.8702 -69.8702 -69.8702 -69.8702 -39.6426 -39.6426 -39.6425 -39.6425 -38.4803 -38.4803 -38.4803 -38.4803 -38.3875 -38.3875 -38.3874 -38.3874 -19.4514 -19.4514 -19.4514 -19.4514 -15.9462 -15.9462 -15.9443 -15.9443 -6.1891 -6.1891 -6.0990 -6.0990 -4.3369 -4.3369 -4.2565 -4.2565 -4.1075 -4.1075 -4.0612 -4.0612 -0.2271 -0.2271 -0.2262 -0.2262 2.3714 2.3714 2.4128 2.4128 2.7183 2.7183 2.7467 2.7467 2.9239 2.9239 2.9654 2.9654 4.7961 4.7961 4.8255 4.8255 6.1307 6.1307 6.2814 6.2814 6.5330 6.5330 6.6087 6.6087 7.6092 7.6092 7.6168 7.6168 7.7028 7.7028 7.7056 7.7056 8.3694 8.3694 8.3989 8.3989 8.6084 8.6084 8.6227 8.6227 9.4260 9.4260 9.4274 9.4274 11.2051 11.2051 11.2356 11.2356 k = 0.3611 0.5000-0.0000 ( 15936 PWs) bands (ev): -69.8703 -69.8703 -69.8703 -69.8703 -39.6426 -39.6426 -39.6425 -39.6425 -38.4804 -38.4804 -38.4803 -38.4803 -38.3874 -38.3874 -38.3874 -38.3874 -19.4496 -19.4496 -19.4496 -19.4496 -15.9491 -15.9491 -15.9473 -15.9473 -6.1869 -6.1869 -6.1025 -6.1025 -4.3355 -4.3355 -4.2573 -4.2573 -4.1062 -4.1062 -4.0661 -4.0661 -0.2205 -0.2205 -0.2196 -0.2196 2.3709 2.3709 2.4087 2.4087 2.7315 2.7315 2.7594 2.7594 2.9267 2.9267 2.9661 2.9661 4.7808 4.7808 4.8086 4.8086 6.1297 6.1297 6.2707 6.2707 6.5380 6.5380 6.6083 6.6083 7.6053 7.6053 7.6120 7.6120 7.6858 7.6858 7.6898 7.6898 8.3652 8.3652 8.3947 8.3947 8.5935 8.5935 8.6077 8.6077 9.4141 9.4141 9.4146 9.4146 11.2077 11.2077 11.2374 11.2374 k = 0.3750 0.5000-0.0000 ( 15936 PWs) bands (ev): -69.8703 -69.8703 -69.8703 -69.8703 -39.6426 -39.6426 -39.6425 -39.6425 -38.4804 -38.4804 -38.4804 -38.4804 -38.3874 -38.3874 -38.3874 -38.3874 -19.4479 -19.4479 -19.4479 -19.4479 -15.9517 -15.9517 -15.9500 -15.9500 -6.1843 -6.1843 -6.1064 -6.1064 -4.3334 -4.3334 -4.2586 -4.2586 -4.1051 -4.1051 -4.0708 -4.0708 -0.2142 -0.2142 -0.2135 -0.2135 2.3708 2.3708 2.4050 2.4050 2.7445 2.7445 2.7715 2.7715 2.9290 2.9290 2.9660 2.9660 4.7665 4.7665 4.7925 4.7925 6.1304 6.1304 6.2606 6.2606 6.5429 6.5429 6.6075 6.6075 7.6029 7.6029 7.6081 7.6081 7.6697 7.6697 7.6751 7.6751 8.3585 8.3585 8.3873 8.3873 8.5797 8.5797 8.5935 8.5935 9.4075 9.4075 9.4075 9.4075 11.2118 11.2118 11.2403 11.2403 k = 0.3889 0.5000-0.0000 ( 15946 PWs) bands (ev): -69.8706 -69.8706 -69.8706 -69.8706 -39.6426 -39.6426 -39.6426 -39.6426 -38.4804 -38.4804 -38.4804 -38.4804 -38.3874 -38.3874 -38.3873 -38.3873 -19.4463 -19.4463 -19.4463 -19.4463 -15.9541 -15.9541 -15.9526 -15.9526 -6.1813 -6.1813 -6.1105 -6.1105 -4.3306 -4.3306 -4.2604 -4.2604 -4.1042 -4.1042 -4.0753 -4.0753 -0.2085 -0.2085 -0.2079 -0.2079 2.3710 2.3710 2.4015 2.4015 2.7570 2.7570 2.7830 2.7830 2.9308 2.9308 2.9653 2.9653 4.7528 4.7528 4.7766 4.7766 6.1325 6.1325 6.2510 6.2510 6.5476 6.5476 6.6064 6.6064 7.6005 7.6005 7.6042 7.6042 7.6554 7.6554 7.6622 7.6622 8.3505 8.3505 8.3780 8.3780 8.5680 8.5680 8.5810 8.5810 9.3978 9.3978 9.3983 9.3983 11.2170 11.2170 11.2440 11.2440 k = 0.4028 0.5000-0.0000 ( 15934 PWs) bands (ev): -69.8703 -69.8703 -69.8703 -69.8703 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4804 -38.4804 -38.3873 -38.3873 -38.3873 -38.3873 -19.4449 -19.4449 -19.4449 -19.4449 -15.9562 -15.9562 -15.9549 -15.9549 -6.1781 -6.1781 -6.1148 -6.1148 -4.3272 -4.3272 -4.2627 -4.2627 -4.1034 -4.1034 -4.0795 -4.0795 -0.2033 -0.2033 -0.2028 -0.2028 2.3716 2.3716 2.3983 2.3983 2.7689 2.7689 2.7935 2.7935 2.9322 2.9322 2.9640 2.9640 4.7404 4.7404 4.7617 4.7617 6.1360 6.1360 6.2419 6.2419 6.5525 6.5525 6.6049 6.6049 7.6010 7.6010 7.6029 7.6029 7.6441 7.6441 7.6521 7.6521 8.3433 8.3433 8.3686 8.3686 8.5614 8.5614 8.5730 8.5730 9.3914 9.3914 9.3922 9.3922 11.2238 11.2238 11.2490 11.2490 k = 0.4167 0.5000-0.0000 ( 15938 PWs) bands (ev): -69.8704 -69.8704 -69.8704 -69.8704 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3873 -38.3873 -38.3873 -38.3873 -19.4436 -19.4436 -19.4436 -19.4436 -15.9581 -15.9581 -15.9570 -15.9570 -6.1745 -6.1745 -6.1193 -6.1193 -4.3233 -4.3233 -4.2656 -4.2656 -4.1027 -4.1027 -4.0834 -4.0834 -0.1987 -0.1987 -0.1983 -0.1983 2.3724 2.3724 2.3953 2.3953 2.7802 2.7802 2.8029 2.8029 2.9333 2.9333 2.9620 2.9620 4.7293 4.7293 4.7480 4.7480 6.1404 6.1404 6.2330 6.2330 6.5571 6.5571 6.6028 6.6028 7.6000 7.6000 7.6001 7.6001 7.6324 7.6324 7.6416 7.6416 8.3342 8.3342 8.3568 8.3568 8.5564 8.5564 8.5664 8.5664 9.3862 9.3862 9.3871 9.3871 11.2304 11.2304 11.2532 11.2532 k = 0.4306 0.5000-0.0000 ( 15910 PWs) bands (ev): -69.8695 -69.8695 -69.8695 -69.8695 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3873 -38.3873 -38.3872 -38.3872 -19.4426 -19.4426 -19.4426 -19.4426 -15.9597 -15.9597 -15.9587 -15.9587 -6.1706 -6.1706 -6.1239 -6.1239 -4.3189 -4.3189 -4.2690 -4.2690 -4.1020 -4.1020 -4.0868 -4.0868 -0.1948 -0.1948 -0.1944 -0.1944 2.3734 2.3734 2.3926 2.3926 2.7906 2.7906 2.8109 2.8109 2.9344 2.9344 2.9596 2.9596 4.7201 4.7201 4.7359 4.7359 6.1461 6.1461 6.2246 6.2246 6.5619 6.5619 6.6007 6.6007 7.5997 7.5997 7.6016 7.6016 7.6249 7.6249 7.6349 7.6349 8.3309 8.3309 8.3503 8.3503 8.5547 8.5547 8.5631 8.5631 9.3834 9.3834 9.3843 9.3843 11.2382 11.2382 11.2581 11.2581 k = 0.4444 0.5000-0.0000 ( 15902 PWs) bands (ev): -69.8693 -69.8693 -69.8693 -69.8693 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4417 -19.4417 -19.4417 -19.4417 -15.9610 -15.9610 -15.9602 -15.9602 -6.1665 -6.1665 -6.1287 -6.1287 -4.3141 -4.3141 -4.2730 -4.2730 -4.1013 -4.1013 -4.0898 -4.0898 -0.1915 -0.1915 -0.1911 -0.1911 2.3747 2.3747 2.3900 2.3900 2.8000 2.8000 2.8173 2.8173 2.9356 2.9356 2.9568 2.9568 4.7125 4.7125 4.7253 4.7253 6.1523 6.1523 6.2160 6.2160 6.5664 6.5664 6.5979 6.5979 7.5990 7.5990 7.6027 7.6027 7.6179 7.6179 7.6284 7.6284 8.3234 8.3234 8.3393 8.3393 8.5533 8.5533 8.5599 8.5599 9.3816 9.3816 9.3824 9.3824 11.2454 11.2454 11.2621 11.2621 k = 0.4583 0.5000-0.0000 ( 15916 PWs) bands (ev): -69.8697 -69.8697 -69.8697 -69.8697 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4410 -19.4410 -19.4410 -19.4410 -15.9620 -15.9620 -15.9614 -15.9614 -6.1621 -6.1621 -6.1335 -6.1335 -4.3090 -4.3090 -4.2774 -4.2774 -4.1006 -4.1006 -4.0924 -4.0924 -0.1889 -0.1889 -0.1886 -0.1886 2.3761 2.3761 2.3876 2.3876 2.8082 2.8082 2.8220 2.8220 2.9370 2.9370 2.9537 2.9537 4.7068 4.7068 4.7165 4.7165 6.1592 6.1592 6.2075 6.2075 6.5707 6.5707 6.5947 6.5947 7.5969 7.5969 7.6022 7.6022 7.6107 7.6107 7.6214 7.6214 8.3178 8.3178 8.3300 8.3300 8.5483 8.5483 8.5532 8.5532 9.3795 9.3795 9.3801 9.3801 11.2514 11.2514 11.2644 11.2644 k = 0.4722 0.5000-0.0000 ( 15920 PWs) bands (ev): -69.8699 -69.8699 -69.8699 -69.8699 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4405 -19.4405 -19.4405 -19.4405 -15.9627 -15.9627 -15.9623 -15.9623 -6.1576 -6.1576 -6.1384 -6.1384 -4.3037 -4.3037 -4.2823 -4.2823 -4.0998 -4.0998 -4.0945 -4.0945 -0.1870 -0.1870 -0.1868 -0.1868 2.3777 2.3777 2.3853 2.3853 2.8150 2.8150 2.8246 2.8246 2.9389 2.9389 2.9504 2.9504 4.7031 4.7031 4.7096 4.7096 6.1665 6.1665 6.1990 6.1990 6.5751 6.5751 6.5912 6.5912 7.5965 7.5965 7.6023 7.6023 7.6073 7.6073 7.6168 7.6168 8.3133 8.3133 8.3216 8.3216 8.5454 8.5454 8.5487 8.5487 9.3787 9.3787 9.3792 9.3792 11.2573 11.2573 11.2662 11.2662 k = 0.4861 0.5000-0.0000 ( 15916 PWs) bands (ev): -69.8697 -69.8697 -69.8697 -69.8697 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4402 -19.4402 -19.4402 -19.4402 -15.9631 -15.9631 -15.9629 -15.9629 -6.1529 -6.1529 -6.1433 -6.1433 -4.2983 -4.2983 -4.2874 -4.2874 -4.0989 -4.0989 -4.0963 -4.0963 -0.1858 -0.1858 -0.1857 -0.1857 2.3794 2.3794 2.3832 2.3832 2.8202 2.8202 2.8252 2.8252 2.9412 2.9412 2.9471 2.9471 4.7019 4.7019 4.7051 4.7051 6.1743 6.1743 6.1907 6.1907 6.5795 6.5795 6.5876 6.5876 7.5964 7.5964 7.5997 7.5997 7.6080 7.6080 7.6132 7.6132 8.3122 8.3122 8.3164 8.3164 8.5440 8.5440 8.5456 8.5456 9.3806 9.3806 9.3808 9.3808 11.2622 11.2622 11.2668 11.2668 k = 0.5000 0.5000-0.0000 ( 15912 PWs) bands (ev): -69.8696 -69.8696 -69.8696 -69.8696 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1481 -6.1481 -6.1481 -6.1481 -4.2928 -4.2928 -4.2928 -4.2928 -4.0977 -4.0977 -4.0977 -4.0977 -0.1854 -0.1854 -0.1854 -0.1854 2.3812 2.3812 2.3812 2.3812 2.8237 2.8237 2.8237 2.8237 2.9440 2.9440 2.9440 2.9440 4.7024 4.7024 4.7024 4.7024 6.1824 6.1824 6.1824 6.1824 6.5837 6.5837 6.5837 6.5837 7.5983 7.5983 7.5983 7.5983 7.6108 7.6108 7.6108 7.6108 8.3132 8.3132 8.3132 8.3132 8.5444 8.5444 8.5444 8.5444 9.3806 9.3806 9.3806 9.3806 11.2656 11.2656 11.2656 11.2656 k = 0.5000 0.5000-0.0000 ( 15912 PWs) bands (ev): -69.8696 -69.8696 -69.8696 -69.8696 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1481 -6.1481 -6.1481 -6.1481 -4.2928 -4.2928 -4.2928 -4.2928 -4.0977 -4.0977 -4.0977 -4.0977 -0.1854 -0.1854 -0.1854 -0.1854 2.3812 2.3812 2.3812 2.3812 2.8237 2.8237 2.8237 2.8237 2.9440 2.9440 2.9440 2.9440 4.7024 4.7024 4.7024 4.7024 6.1824 6.1824 6.1824 6.1824 6.5837 6.5837 6.5837 6.5837 7.5983 7.5983 7.5983 7.5983 7.6108 7.6108 7.6108 7.6108 8.3132 8.3132 8.3132 8.3132 8.5444 8.5444 8.5444 8.5444 9.3806 9.3806 9.3806 9.3806 11.2656 11.2656 11.2656 11.2656 k = 0.4900 0.4900-0.0000 ( 15919 PWs) bands (ev): -69.8700 -69.8700 -69.8696 -69.8696 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4403 -19.4403 -19.4401 -19.4401 -15.9631 -15.9631 -15.9629 -15.9629 -6.1530 -6.1530 -6.1432 -6.1432 -4.2984 -4.2984 -4.2873 -4.2873 -4.0989 -4.0989 -4.0963 -4.0963 -0.1863 -0.1863 -0.1852 -0.1852 2.3793 2.3793 2.3833 2.3833 2.8201 2.8201 2.8252 2.8252 2.9411 2.9411 2.9472 2.9472 4.7016 4.7016 4.7051 4.7051 6.1742 6.1742 6.1908 6.1908 6.5793 6.5793 6.5876 6.5876 7.5962 7.5962 7.6000 7.6000 7.6075 7.6075 7.6133 7.6133 8.3118 8.3118 8.3168 8.3168 8.5438 8.5438 8.5458 8.5458 9.3787 9.3787 9.3807 9.3807 11.2618 11.2618 11.2669 11.2669 k = 0.4800 0.4800-0.0000 ( 15921 PWs) bands (ev): -69.8707 -69.8707 -69.8691 -69.8691 -39.6426 -39.6426 -39.6426 -39.6426 -38.4806 -38.4806 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4409 -19.4409 -19.4401 -19.4401 -15.9627 -15.9627 -15.9623 -15.9623 -6.1578 -6.1578 -6.1382 -6.1382 -4.3040 -4.3040 -4.2819 -4.2819 -4.1000 -4.1000 -4.0944 -4.0944 -0.1892 -0.1892 -0.1848 -0.1848 2.3773 2.3773 2.3857 2.3857 2.8145 2.8145 2.8249 2.8249 2.9381 2.9381 2.9511 2.9511 4.7028 4.7028 4.7104 4.7104 6.1661 6.1661 6.1993 6.1993 6.5746 6.5746 6.5917 6.5917 7.5956 7.5956 7.6034 7.6034 7.6072 7.6072 7.6177 7.6177 8.3080 8.3080 8.3263 8.3263 8.5431 8.5431 8.5495 8.5495 9.3775 9.3775 9.3812 9.3812 11.2547 11.2547 11.2687 11.2687 k = 0.4700 0.4700-0.0000 ( 15913 PWs) bands (ev): -69.8701 -69.8701 -69.8692 -69.8692 -39.6427 -39.6427 -39.6425 -39.6425 -38.4806 -38.4806 -38.4804 -38.4804 -38.3872 -38.3872 -38.3872 -38.3872 -19.4419 -19.4419 -19.4401 -19.4401 -15.9620 -15.9620 -15.9613 -15.9613 -6.1625 -6.1625 -6.1331 -6.1331 -4.3098 -4.3098 -4.2767 -4.2767 -4.1010 -4.1010 -4.0920 -4.0920 -0.1939 -0.1939 -0.1839 -0.1839 2.3751 2.3751 2.3886 2.3886 2.8070 2.8070 2.8228 2.8228 2.9346 2.9346 2.9558 2.9558 4.7060 4.7060 4.7184 4.7184 6.1584 6.1584 6.2081 6.2081 6.5695 6.5695 6.5960 6.5960 7.5962 7.5962 7.6044 7.6044 7.6113 7.6113 7.6235 7.6235 8.3107 8.3107 8.3366 8.3366 8.5443 8.5443 8.5554 8.5554 9.3796 9.3796 9.3806 9.3806 11.2444 11.2444 11.2728 11.2728 k = 0.4600 0.4600-0.0000 ( 15907 PWs) bands (ev): -69.8699 -69.8699 -69.8690 -69.8690 -39.6427 -39.6427 -39.6425 -39.6425 -38.4807 -38.4807 -38.4803 -38.4803 -38.3873 -38.3873 -38.3872 -38.3872 -19.4434 -19.4434 -19.4401 -19.4401 -15.9610 -15.9610 -15.9600 -15.9600 -6.1670 -6.1670 -6.1280 -6.1280 -4.3156 -4.3156 -4.2715 -4.2715 -4.1020 -4.1020 -4.0890 -4.0890 -0.2004 -0.2004 -0.1828 -0.1828 2.3726 2.3726 2.3922 2.3922 2.7979 2.7979 2.8192 2.8192 2.9305 2.9305 2.9610 2.9610 4.7108 4.7108 4.7292 4.7292 6.1509 6.1509 6.2169 6.2169 6.5635 6.5635 6.6007 6.6007 7.5980 7.5980 7.6038 7.6038 7.6176 7.6176 7.6309 7.6309 8.3104 8.3104 8.3543 8.3543 8.5439 8.5439 8.5634 8.5634 9.3792 9.3792 9.3834 9.3834 11.2316 11.2316 11.2772 11.2772 k = 0.4500 0.4500-0.0000 ( 15915 PWs) bands (ev): -69.8704 -69.8704 -69.8689 -69.8689 -39.6428 -39.6428 -39.6424 -39.6424 -38.4808 -38.4808 -38.4801 -38.4801 -38.3873 -38.3873 -38.3872 -38.3872 -19.4452 -19.4452 -19.4401 -19.4401 -15.9597 -15.9597 -15.9584 -15.9584 -6.1715 -6.1715 -6.1229 -6.1229 -4.3214 -4.3214 -4.2664 -4.2664 -4.1031 -4.1031 -4.0855 -4.0855 -0.2089 -0.2089 -0.1815 -0.1815 2.3698 2.3698 2.3966 2.3966 2.7874 2.7874 2.8142 2.8142 2.9254 2.9254 2.9667 2.9667 4.7172 4.7172 4.7428 4.7428 6.1435 6.1435 6.2257 6.2257 6.5564 6.5564 6.6055 6.6055 7.5982 7.5982 7.6011 7.6011 7.6257 7.6257 7.6388 7.6388 8.3095 8.3095 8.3742 8.3742 8.5399 8.5399 8.5715 8.5715 9.3795 9.3795 9.3890 9.3890 11.2167 11.2167 11.2814 11.2814 k = 0.4400 0.4400-0.0000 ( 15909 PWs) bands (ev): -69.8698 -69.8698 -69.8692 -69.8692 -39.6429 -39.6429 -39.6423 -39.6423 -38.4810 -38.4810 -38.4799 -38.4799 -38.3873 -38.3873 -38.3872 -38.3872 -19.4475 -19.4475 -19.4401 -19.4401 -15.9581 -15.9581 -15.9564 -15.9564 -6.1758 -6.1758 -6.1178 -6.1178 -4.3272 -4.3272 -4.2614 -4.2614 -4.1043 -4.1043 -4.0814 -4.0814 -0.2191 -0.2191 -0.1800 -0.1800 2.3667 2.3667 2.4017 2.4017 2.7757 2.7757 2.8079 2.8079 2.9195 2.9195 2.9725 2.9725 4.7256 4.7256 4.7593 4.7593 6.1365 6.1365 6.2347 6.2347 6.5483 6.5483 6.6110 6.6110 7.5995 7.5995 7.6015 7.6015 7.6353 7.6353 7.6487 7.6487 8.3098 8.3098 8.3986 8.3986 8.5412 8.5412 8.5785 8.5785 9.3791 9.3791 9.4000 9.4000 11.2012 11.2012 11.2874 11.2874 k = 0.4300 0.4300-0.0000 ( 15925 PWs) bands (ev): -69.8701 -69.8701 -69.8699 -69.8699 -39.6430 -39.6430 -39.6422 -39.6422 -38.4812 -38.4812 -38.4797 -38.4797 -38.3874 -38.3874 -38.3872 -38.3872 -19.4501 -19.4501 -19.4401 -19.4401 -15.9563 -15.9563 -15.9540 -15.9540 -6.1799 -6.1799 -6.1127 -6.1127 -4.3330 -4.3330 -4.2564 -4.2564 -4.1057 -4.1057 -4.0768 -4.0768 -0.2311 -0.2311 -0.1784 -0.1784 2.3634 2.3634 2.4077 2.4077 2.7630 2.7630 2.8005 2.8005 2.9125 2.9125 2.9784 2.9784 4.7349 4.7349 4.7784 4.7784 6.1296 6.1296 6.2436 6.2436 6.5386 6.5386 6.6164 6.6164 7.5972 7.5972 7.5992 7.5992 7.6452 7.6452 7.6588 7.6588 8.3123 8.3123 8.4246 8.4246 8.5413 8.5413 8.5878 8.5878 9.3769 9.3769 9.4075 9.4075 11.1852 11.1852 11.2915 11.2915 k = 0.4200 0.4200-0.0000 ( 15941 PWs) bands (ev): -69.8711 -69.8711 -69.8699 -69.8699 -39.6431 -39.6431 -39.6420 -39.6420 -38.4813 -38.4813 -38.4795 -38.4795 -38.3875 -38.3875 -38.3872 -38.3872 -19.4532 -19.4532 -19.4402 -19.4402 -15.9541 -15.9541 -15.9514 -15.9514 -6.1838 -6.1838 -6.1077 -6.1077 -4.3387 -4.3387 -4.2515 -4.2515 -4.1071 -4.1071 -4.0717 -4.0717 -0.2448 -0.2448 -0.1769 -0.1769 2.3599 2.3599 2.4144 2.4144 2.7496 2.7496 2.7921 2.7921 2.9045 2.9045 2.9840 2.9840 4.7458 4.7458 4.8005 4.8005 6.1229 6.1229 6.2523 6.2523 6.5278 6.5278 6.6224 6.6224 7.5949 7.5949 7.5995 7.5995 7.6590 7.6590 7.6723 7.6723 8.3078 8.3078 8.4549 8.4549 8.5379 8.5379 8.5998 8.5998 9.3741 9.3741 9.4154 9.4154 11.1714 11.1714 11.2959 11.2959 k = 0.4100 0.4100-0.0000 ( 15929 PWs) bands (ev): -69.8711 -69.8711 -69.8691 -69.8691 -39.6432 -39.6432 -39.6419 -39.6419 -38.4815 -38.4815 -38.4792 -38.4792 -38.3875 -38.3875 -38.3872 -38.3872 -19.4565 -19.4565 -19.4402 -19.4402 -15.9517 -15.9517 -15.9484 -15.9484 -6.1876 -6.1876 -6.1027 -6.1027 -4.3443 -4.3443 -4.2467 -4.2467 -4.1086 -4.1086 -4.0661 -4.0661 -0.2602 -0.2602 -0.1753 -0.1753 2.3564 2.3564 2.4221 2.4221 2.7356 2.7356 2.7827 2.7827 2.8955 2.8955 2.9894 2.9894 4.7587 4.7587 4.8255 4.8255 6.1165 6.1165 6.2614 6.2614 6.5157 6.5157 6.6293 6.6293 7.5946 7.5946 7.5999 7.5999 7.6769 7.6769 7.6875 7.6875 8.3098 8.3098 8.4919 8.4919 8.5352 8.5352 8.6154 8.6154 9.3749 9.3749 9.4297 9.4297 11.1589 11.1589 11.3003 11.3003 k = 0.4000 0.4000-0.0000 ( 15929 PWs) bands (ev): -69.8712 -69.8712 -69.8691 -69.8691 -39.6434 -39.6434 -39.6417 -39.6417 -38.4818 -38.4818 -38.4789 -38.4789 -38.3876 -38.3876 -38.3872 -38.3872 -19.4602 -19.4602 -19.4402 -19.4402 -15.9491 -15.9491 -15.9452 -15.9452 -6.1912 -6.1912 -6.0977 -6.0977 -4.3497 -4.3497 -4.2419 -4.2419 -4.1102 -4.1102 -4.0602 -4.0602 -0.2772 -0.2772 -0.1740 -0.1740 2.3530 2.3530 2.4305 2.4305 2.7210 2.7210 2.7725 2.7725 2.8854 2.8854 2.9945 2.9945 4.7731 4.7731 4.8531 4.8531 6.1104 6.1104 6.2704 6.2704 6.5018 6.5018 6.6362 6.6362 7.5941 7.5941 7.5998 7.5998 7.6928 7.6928 7.7026 7.7026 8.3143 8.3143 8.5258 8.5258 8.5351 8.5351 8.6331 8.6331 9.3763 9.3763 9.4426 9.4426 11.1477 11.1477 11.3039 11.3039 k = 0.3900 0.3900-0.0000 ( 15931 PWs) bands (ev): -69.8719 -69.8719 -69.8685 -69.8685 -39.6435 -39.6435 -39.6415 -39.6415 -38.4820 -38.4820 -38.4786 -38.4786 -38.3877 -38.3877 -38.3872 -38.3872 -19.4643 -19.4643 -19.4402 -19.4402 -15.9462 -15.9462 -15.9416 -15.9416 -6.1945 -6.1945 -6.0928 -6.0928 -4.3550 -4.3550 -4.2371 -4.2371 -4.1117 -4.1117 -4.0539 -4.0539 -0.2957 -0.2957 -0.1728 -0.1728 2.3498 2.3498 2.4397 2.4397 2.7060 2.7060 2.7615 2.7615 2.8744 2.8744 2.9991 2.9991 4.7889 4.7889 4.8836 4.8836 6.1043 6.1043 6.2792 6.2792 6.4864 6.4864 6.6440 6.6440 7.5928 7.5928 7.6006 7.6006 7.7122 7.7122 7.7204 7.7204 8.3136 8.3136 8.5278 8.5278 8.5715 8.5715 8.6498 8.6498 9.3776 9.3776 9.4561 9.4561 11.1390 11.1390 11.3058 11.3058 k = 0.3800 0.3800-0.0000 ( 15923 PWs) bands (ev): -69.8715 -69.8715 -69.8684 -69.8684 -39.6437 -39.6437 -39.6413 -39.6413 -38.4823 -38.4823 -38.4782 -38.4782 -38.3877 -38.3877 -38.3872 -38.3872 -19.4686 -19.4686 -19.4403 -19.4403 -15.9431 -15.9431 -15.9378 -15.9378 -6.1977 -6.1977 -6.0880 -6.0880 -4.3600 -4.3600 -4.2324 -4.2324 -4.1133 -4.1133 -4.0474 -4.0474 -0.3157 -0.3157 -0.1720 -0.1720 2.3468 2.3468 2.4497 2.4497 2.6906 2.6906 2.7499 2.7499 2.8623 2.8623 3.0032 3.0032 4.8066 4.8066 4.9165 4.9165 6.0985 6.0985 6.2881 6.2881 6.4698 6.4698 6.6517 6.6517 7.5915 7.5915 7.6044 7.6044 7.7308 7.7308 7.7399 7.7399 8.3175 8.3175 8.5255 8.5255 8.6137 8.6137 8.6699 8.6699 9.3779 9.3779 9.4749 9.4749 11.1331 11.1331 11.3066 11.3066 k = 0.3700 0.3700-0.0000 ( 15927 PWs) bands (ev): -69.8718 -69.8718 -69.8683 -69.8683 -39.6439 -39.6439 -39.6411 -39.6411 -38.4826 -38.4826 -38.4779 -38.4779 -38.3878 -38.3878 -38.3872 -38.3872 -19.4733 -19.4733 -19.4403 -19.4403 -15.9397 -15.9397 -15.9337 -15.9337 -6.2006 -6.2006 -6.0834 -6.0834 -4.3647 -4.3647 -4.2279 -4.2279 -4.1148 -4.1148 -4.0407 -4.0407 -0.3371 -0.3371 -0.1717 -0.1717 2.3442 2.3442 2.4604 2.4604 2.6750 2.6750 2.7377 2.7377 2.8493 2.8493 3.0069 3.0069 4.8253 4.8253 4.9520 4.9520 6.0927 6.0927 6.2966 6.2966 6.4515 6.4515 6.6596 6.6596 7.5882 7.5882 7.6088 7.6088 7.7522 7.7522 7.7609 7.7609 8.3209 8.3209 8.5224 8.5224 8.6569 8.6569 8.6894 8.6894 9.3782 9.3782 9.4884 9.4884 11.1297 11.1297 11.3049 11.3049 k = 0.3600 0.3600-0.0000 ( 15919 PWs) bands (ev): -69.8717 -69.8717 -69.8680 -69.8680 -39.6441 -39.6441 -39.6409 -39.6409 -38.4829 -38.4829 -38.4775 -38.4775 -38.3879 -38.3879 -38.3872 -38.3872 -19.4782 -19.4782 -19.4404 -19.4404 -15.9362 -15.9362 -15.9294 -15.9294 -6.2032 -6.2032 -6.0788 -6.0788 -4.3691 -4.3691 -4.2234 -4.2234 -4.1161 -4.1161 -4.0338 -4.0338 -0.3597 -0.3597 -0.1718 -0.1718 2.3421 2.3421 2.4717 2.4717 2.6592 2.6592 2.7250 2.7250 2.8354 2.8354 3.0100 3.0100 4.8458 4.8458 4.9899 4.9899 6.0870 6.0870 6.3051 6.3051 6.4321 6.4321 6.6680 6.6680 7.5845 7.5845 7.6163 7.6163 7.7751 7.7751 7.7835 7.7835 8.3255 8.3255 8.5198 8.5198 8.7030 8.7030 8.7128 8.7128 9.3766 9.3766 9.5064 9.5064 11.1291 11.1291 11.3014 11.3014 k = 0.3500 0.3500-0.0000 ( 15935 PWs) bands (ev): -69.8715 -69.8715 -69.8692 -69.8692 -39.6443 -39.6443 -39.6406 -39.6406 -38.4832 -38.4832 -38.4770 -38.4770 -38.3880 -38.3880 -38.3872 -38.3872 -19.4834 -19.4834 -19.4404 -19.4404 -15.9324 -15.9324 -15.9249 -15.9249 -6.2056 -6.2056 -6.0744 -6.0744 -4.3732 -4.3732 -4.2191 -4.2191 -4.1173 -4.1173 -4.0268 -4.0268 -0.3836 -0.3836 -0.1725 -0.1725 2.3405 2.3405 2.4836 2.4836 2.6433 2.6433 2.7121 2.7121 2.8206 2.8206 3.0125 3.0125 4.8676 4.8676 5.0301 5.0301 6.0811 6.0811 6.3126 6.3126 6.4112 6.4112 6.6756 6.6756 7.5801 7.5801 7.6242 7.6242 7.7965 7.7965 7.8052 7.8052 8.3274 8.3274 8.5181 8.5181 8.7290 8.7290 8.7488 8.7488 9.3737 9.3737 9.5246 9.5246 11.1302 11.1302 11.2953 11.2953 k = 0.3400 0.3400-0.0000 ( 15945 PWs) bands (ev): -69.8726 -69.8726 -69.8687 -69.8687 -39.6445 -39.6445 -39.6404 -39.6404 -38.4836 -38.4836 -38.4766 -38.4766 -38.3881 -38.3881 -38.3872 -38.3872 -19.4887 -19.4887 -19.4405 -19.4405 -15.9285 -15.9285 -15.9202 -15.9202 -6.2078 -6.2078 -6.0701 -6.0701 -4.3770 -4.3770 -4.2150 -4.2150 -4.1181 -4.1181 -4.0198 -4.0198 -0.4085 -0.4085 -0.1738 -0.1738 2.3395 2.3395 2.4960 2.4960 2.6273 2.6273 2.6989 2.6989 2.8051 2.8051 3.0145 3.0145 4.8907 4.8907 5.0729 5.0729 6.0752 6.0752 6.3198 6.3198 6.3898 6.3898 6.6844 6.6844 7.5721 7.5721 7.6323 7.6323 7.8198 7.8198 7.8286 7.8286 8.3317 8.3317 8.5097 8.5097 8.7546 8.7546 8.7973 8.7973 9.3752 9.3752 9.5395 9.5395 11.1353 11.1353 11.2862 11.2862 k = 0.3300 0.3300-0.0000 ( 15943 PWs) bands (ev): -69.8721 -69.8721 -69.8691 -69.8691 -39.6448 -39.6448 -39.6401 -39.6401 -38.4840 -38.4840 -38.4761 -38.4761 -38.3882 -38.3882 -38.3871 -38.3871 -19.4943 -19.4943 -19.4405 -19.4405 -15.9243 -15.9243 -15.9153 -15.9153 -6.2097 -6.2097 -6.0660 -6.0660 -4.3803 -4.3803 -4.2113 -4.2113 -4.1186 -4.1186 -4.0129 -4.0129 -0.4343 -0.4343 -0.1758 -0.1758 2.3391 2.3391 2.5088 2.5088 2.6113 2.6113 2.6856 2.6856 2.7888 2.7888 3.0160 3.0160 4.9148 4.9148 5.1179 5.1179 6.0693 6.0693 6.3245 6.3245 6.3699 6.3699 6.6926 6.6926 7.5646 7.5646 7.6464 7.6464 7.8438 7.8438 7.8535 7.8535 8.3397 8.3397 8.5089 8.5089 8.7790 8.7790 8.8452 8.8452 9.3743 9.3743 9.5538 9.5538 11.1427 11.1427 11.2769 11.2769 k = 0.3200 0.3200-0.0000 ( 15915 PWs) bands (ev): -69.8716 -69.8716 -69.8678 -69.8678 -39.6450 -39.6450 -39.6399 -39.6399 -38.4843 -38.4843 -38.4756 -38.4756 -38.3883 -38.3883 -38.3871 -38.3871 -19.5001 -19.5001 -19.4406 -19.4406 -15.9201 -15.9201 -15.9103 -15.9103 -6.2113 -6.2113 -6.0620 -6.0620 -4.3831 -4.3831 -4.2079 -4.2079 -4.1187 -4.1187 -4.0060 -4.0060 -0.4609 -0.4609 -0.1785 -0.1785 2.3393 2.3393 2.5217 2.5217 2.5954 2.5954 2.6725 2.6725 2.7719 2.7719 3.0168 3.0168 4.9401 4.9401 5.1652 5.1652 6.0633 6.0633 6.3222 6.3222 6.3574 6.3574 6.7029 6.7029 7.5581 7.5581 7.6599 7.6599 7.8715 7.8715 7.8817 7.8817 8.3510 8.3510 8.5057 8.5057 8.8113 8.8113 8.8975 8.8975 9.3758 9.3758 9.5697 9.5697 11.1525 11.1525 11.2650 11.2650 k = 0.3100 0.3100-0.0000 ( 15919 PWs) bands (ev): -69.8717 -69.8717 -69.8681 -69.8681 -39.6452 -39.6452 -39.6396 -39.6396 -38.4847 -38.4847 -38.4751 -38.4751 -38.3884 -38.3884 -38.3871 -38.3871 -19.5060 -19.5060 -19.4406 -19.4406 -15.9157 -15.9157 -15.9051 -15.9051 -6.2126 -6.2126 -6.0583 -6.0583 -4.3856 -4.3856 -4.2050 -4.2050 -4.1182 -4.1182 -3.9993 -3.9993 -0.4883 -0.4883 -0.1820 -0.1820 2.3401 2.3401 2.5345 2.5345 2.5796 2.5796 2.6597 2.6597 2.7544 2.7544 3.0172 3.0172 4.9659 4.9659 5.2144 5.2144 6.0567 6.0567 6.3061 6.3061 6.3568 6.3568 6.7117 6.7117 7.5487 7.5487 7.6741 7.6741 7.8973 7.8973 7.9085 7.9085 8.3594 8.3594 8.5026 8.5026 8.8386 8.8386 8.9454 8.9454 9.3739 9.3739 9.5825 9.5825 11.1642 11.1642 11.2524 11.2524 k = 0.3000 0.3000-0.0000 ( 15921 PWs) bands (ev): -69.8725 -69.8725 -69.8674 -69.8674 -39.6455 -39.6455 -39.6393 -39.6393 -38.4851 -38.4851 -38.4746 -38.4746 -38.3885 -38.3885 -38.3871 -38.3871 -19.5120 -19.5120 -19.4407 -19.4407 -15.9112 -15.9112 -15.8998 -15.8998 -6.2136 -6.2136 -6.0547 -6.0547 -4.3875 -4.3875 -4.2026 -4.2026 -4.1171 -4.1171 -3.9927 -3.9927 -0.5163 -0.5163 -0.1863 -0.1863 2.3415 2.3415 2.5463 2.5463 2.5644 2.5644 2.6478 2.6478 2.7365 2.7365 3.0170 3.0170 4.9924 4.9924 5.2654 5.2654 6.0498 6.0498 6.2844 6.2844 6.3620 6.3620 6.7218 6.7218 7.5383 7.5383 7.6878 7.6878 7.9256 7.9256 7.9389 7.9389 8.3659 8.3659 8.4961 8.4961 8.8686 8.8686 8.9939 8.9939 9.3723 9.3723 9.5946 9.5946 11.1770 11.1770 11.2394 11.2394 k = 0.2900 0.2900-0.0000 ( 15913 PWs) bands (ev): -69.8720 -69.8720 -69.8673 -69.8673 -39.6457 -39.6457 -39.6390 -39.6390 -38.4855 -38.4855 -38.4741 -38.4741 -38.3886 -38.3886 -38.3871 -38.3871 -19.5182 -19.5182 -19.4408 -19.4408 -15.9066 -15.9066 -15.8945 -15.8945 -6.2144 -6.2144 -6.0514 -6.0514 -4.3890 -4.3890 -4.2007 -4.2007 -4.1153 -4.1153 -3.9864 -3.9864 -0.5447 -0.5447 -0.1913 -0.1913 2.3435 2.3435 2.5465 2.5465 2.5595 2.5595 2.6377 2.6377 2.7183 2.7183 3.0163 3.0163 5.0192 5.0192 5.3185 5.3185 6.0423 6.0423 6.2617 6.2617 6.3687 6.3687 6.7311 6.7311 7.5287 7.5287 7.7054 7.7054 7.9524 7.9524 7.9669 7.9669 8.3787 8.3787 8.4934 8.4934 8.9010 8.9010 9.0396 9.0396 9.3719 9.3719 9.6065 9.6065 11.1901 11.1901 11.2296 11.2296 k = 0.2800 0.2800-0.0000 ( 15911 PWs) bands (ev): -69.8717 -69.8717 -69.8675 -69.8675 -39.6460 -39.6460 -39.6387 -39.6387 -38.4859 -38.4859 -38.4736 -38.4736 -38.3887 -38.3887 -38.3870 -38.3870 -19.5244 -19.5244 -19.4408 -19.4408 -15.9019 -15.9019 -15.8891 -15.8891 -6.2148 -6.2148 -6.0482 -6.0482 -4.3899 -4.3899 -4.1993 -4.1993 -4.1129 -4.1129 -3.9804 -3.9804 -0.5734 -0.5734 -0.1970 -0.1970 2.3459 2.3459 2.5320 2.5320 2.5660 2.5660 2.6313 2.6313 2.6999 2.6999 3.0151 3.0151 5.0458 5.0458 5.3733 5.3733 6.0342 6.0342 6.2394 6.2394 6.3754 6.3754 6.7406 6.7406 7.5171 7.5171 7.7260 7.7260 7.9784 7.9784 7.9949 7.9949 8.3895 8.3895 8.4920 8.4920 8.9329 8.9329 9.0839 9.0839 9.3712 9.3712 9.6155 9.6155 11.1997 11.1997 11.2263 11.2263 k = 0.2700 0.2700-0.0000 ( 15907 PWs) bands (ev): -69.8718 -69.8718 -69.8672 -69.8672 -39.6463 -39.6463 -39.6384 -39.6384 -38.4863 -38.4863 -38.4730 -38.4730 -38.3888 -38.3888 -38.3870 -38.3870 -19.5307 -19.5307 -19.4409 -19.4409 -15.8971 -15.8971 -15.8836 -15.8836 -6.2150 -6.2150 -6.0453 -6.0453 -4.3903 -4.3903 -4.1984 -4.1984 -4.1099 -4.1099 -3.9748 -3.9748 -0.6023 -0.6023 -0.2034 -0.2034 2.3487 2.3487 2.5171 2.5171 2.5673 2.5673 2.6311 2.6311 2.6814 2.6814 3.0134 3.0134 5.0719 5.0719 5.4297 5.4297 6.0255 6.0255 6.2184 6.2184 6.3826 6.3826 6.7507 6.7507 7.5046 7.5046 7.7469 7.7469 8.0043 8.0043 8.0237 8.0237 8.4012 8.4012 8.4903 8.4903 8.9686 8.9686 9.1255 9.1255 9.3703 9.3703 9.6233 9.6233 11.2018 11.2018 11.2346 11.2346 k = 0.2600 0.2600-0.0000 ( 15901 PWs) bands (ev): -69.8712 -69.8712 -69.8674 -69.8674 -39.6465 -39.6465 -39.6381 -39.6381 -38.4868 -38.4868 -38.4725 -38.4725 -38.3889 -38.3889 -38.3870 -38.3870 -19.5370 -19.5370 -19.4410 -19.4410 -15.8923 -15.8923 -15.8782 -15.8782 -6.2148 -6.2148 -6.0427 -6.0427 -4.3902 -4.3902 -4.1980 -4.1980 -4.1063 -4.1063 -3.9695 -3.9695 -0.6313 -0.6313 -0.2104 -0.2104 2.3518 2.3518 2.5023 2.5023 2.5622 2.5622 2.6374 2.6374 2.6632 2.6632 3.0113 3.0113 5.0970 5.0970 5.4873 5.4873 6.0163 6.0163 6.1996 6.1996 6.3892 6.3892 6.7603 6.7603 7.4929 7.4929 7.7696 7.7696 8.0305 8.0305 8.0529 8.0529 8.4157 8.4157 8.4912 8.4912 9.0037 9.0037 9.1626 9.1626 9.3668 9.3668 9.6312 9.6312 11.2018 11.2018 11.2502 11.2502 k = 0.2500 0.2500-0.0000 ( 15897 PWs) bands (ev): -69.8713 -69.8713 -69.8671 -69.8671 -39.6468 -39.6468 -39.6378 -39.6378 -38.4872 -38.4872 -38.4720 -38.4720 -38.3890 -38.3890 -38.3869 -38.3869 -19.5433 -19.5433 -19.4411 -19.4411 -15.8875 -15.8875 -15.8727 -15.8727 -6.2144 -6.2144 -6.0403 -6.0403 -4.3896 -4.3896 -4.1979 -4.1979 -4.1022 -4.1022 -3.9648 -3.9648 -0.6602 -0.6602 -0.2181 -0.2181 2.3552 2.3552 2.4878 2.4878 2.5530 2.5530 2.6423 2.6423 2.6509 2.6509 3.0088 3.0088 5.1205 5.1205 5.5460 5.5460 6.0071 6.0071 6.1831 6.1831 6.3957 6.3957 6.7709 6.7709 7.4794 7.4794 7.7951 7.7951 8.0544 8.0544 8.0822 8.0822 8.4261 8.4261 8.4914 8.4914 9.0408 9.0408 9.1975 9.1975 9.3663 9.3663 9.6378 9.6378 11.2057 11.2057 11.2679 11.2679 k = 0.2400 0.2400-0.0000 ( 15905 PWs) bands (ev): -69.8719 -69.8719 -69.8670 -69.8670 -39.6471 -39.6471 -39.6375 -39.6375 -38.4877 -38.4877 -38.4715 -38.4715 -38.3891 -38.3891 -38.3869 -38.3869 -19.5496 -19.5496 -19.4411 -19.4411 -15.8826 -15.8826 -15.8672 -15.8672 -6.2137 -6.2137 -6.0381 -6.0381 -4.3885 -4.3885 -4.1980 -4.1980 -4.0977 -4.0977 -3.9605 -3.9605 -0.6890 -0.6890 -0.2262 -0.2262 2.3586 2.3586 2.4737 2.4737 2.5418 2.5418 2.6259 2.6259 2.6624 2.6624 3.0059 3.0059 5.1415 5.1415 5.6053 5.6053 5.9984 5.9984 6.1692 6.1692 6.4013 6.4013 6.7818 6.7818 7.4633 7.4633 7.8202 7.8202 8.0763 8.0763 8.1123 8.1123 8.4358 8.4358 8.4918 8.4918 9.0776 9.0776 9.2270 9.2270 9.3646 9.3646 9.6444 9.6444 11.2147 11.2147 11.2868 11.2868 k = 0.2300 0.2300-0.0000 ( 15887 PWs) bands (ev): -69.8717 -69.8717 -69.8661 -69.8661 -39.6473 -39.6473 -39.6372 -39.6372 -38.4881 -38.4881 -38.4709 -38.4709 -38.3891 -38.3891 -38.3868 -38.3868 -19.5559 -19.5559 -19.4412 -19.4412 -15.8778 -15.8778 -15.8618 -15.8618 -6.2128 -6.2128 -6.0361 -6.0361 -4.3869 -4.3869 -4.1984 -4.1984 -4.0929 -4.0929 -3.9568 -3.9568 -0.7174 -0.7174 -0.2348 -0.2348 2.3620 2.3620 2.4599 2.4599 2.5296 2.5296 2.6086 2.6086 2.6764 2.6764 3.0026 3.0026 5.1598 5.1598 5.6647 5.6647 5.9923 5.9923 6.1591 6.1591 6.4084 6.4084 6.7944 6.7944 7.4493 7.4493 7.8469 7.8469 8.0992 8.0992 8.1385 8.1385 8.4486 8.4486 8.4966 8.4966 9.1204 9.1204 9.2536 9.2536 9.3630 9.3630 9.6542 9.6542 11.2304 11.2304 11.3073 11.3073 k = 0.2200 0.2200-0.0000 ( 15895 PWs) bands (ev): -69.8715 -69.8715 -69.8667 -69.8667 -39.6476 -39.6476 -39.6370 -39.6370 -38.4885 -38.4885 -38.4704 -38.4704 -38.3892 -38.3892 -38.3868 -38.3868 -19.5620 -19.5620 -19.4413 -19.4413 -15.8730 -15.8730 -15.8565 -15.8565 -6.2115 -6.2115 -6.0345 -6.0345 -4.3848 -4.3848 -4.1987 -4.1987 -4.0878 -4.0878 -3.9536 -3.9536 -0.7454 -0.7454 -0.2438 -0.2438 2.3653 2.3653 2.4466 2.4466 2.5168 2.5168 2.5919 2.5919 2.6910 2.6910 2.9991 2.9991 5.1742 5.1742 5.7227 5.7227 5.9892 5.9892 6.1510 6.1510 6.4133 6.4133 6.8054 6.8054 7.4359 7.4359 7.8744 7.8744 8.1184 8.1184 8.1604 8.1604 8.4602 8.4602 8.5037 8.5037 9.1591 9.1591 9.2721 9.2721 9.3595 9.3595 9.6636 9.6636 11.2531 11.2531 11.3282 11.3282 k = 0.2100 0.2100-0.0000 ( 15891 PWs) bands (ev): -69.8716 -69.8716 -69.8664 -69.8664 -39.6479 -39.6479 -39.6367 -39.6367 -38.4890 -38.4890 -38.4699 -38.4699 -38.3893 -38.3893 -38.3868 -38.3868 -19.5681 -19.5681 -19.4414 -19.4414 -15.8682 -15.8682 -15.8513 -15.8513 -6.2101 -6.2101 -6.0330 -6.0330 -4.3823 -4.3823 -4.1991 -4.1991 -4.0826 -4.0826 -3.9511 -3.9511 -0.7729 -0.7729 -0.2530 -0.2530 2.3683 2.3683 2.4338 2.4338 2.5037 2.5037 2.5759 2.5759 2.7059 2.7059 2.9953 2.9953 5.1842 5.1842 5.7776 5.7776 5.9930 5.9930 6.1461 6.1461 6.4191 6.4191 6.8180 6.8180 7.4212 7.4212 7.9022 7.9022 8.1361 8.1361 8.1827 8.1827 8.4711 8.4711 8.5142 8.5142 9.2002 9.2002 9.2879 9.2879 9.3573 9.3573 9.6758 9.6758 11.2834 11.2834 11.3498 11.3498 k = 0.2000 0.2000-0.0000 ( 15875 PWs) bands (ev): -69.8711 -69.8711 -69.8659 -69.8659 -39.6481 -39.6481 -39.6364 -39.6364 -38.4894 -38.4894 -38.4694 -38.4694 -38.3894 -38.3894 -38.3867 -38.3867 -19.5741 -19.5741 -19.4415 -19.4415 -15.8636 -15.8636 -15.8461 -15.8461 -6.2084 -6.2084 -6.0318 -6.0318 -4.3794 -4.3794 -4.1993 -4.1993 -4.0773 -4.0773 -3.9493 -3.9493 -0.7998 -0.7998 -0.2625 -0.2625 2.3710 2.3710 2.4214 2.4214 2.4905 2.4905 2.5610 2.5610 2.7208 2.7208 2.9913 2.9913 5.1895 5.1895 5.8258 5.8258 6.0072 6.0072 6.1443 6.1443 6.4252 6.4252 6.8312 6.8312 7.4072 7.4072 7.9336 7.9336 8.1524 8.1524 8.2021 8.2021 8.4828 8.4828 8.5288 8.5288 9.2379 9.2379 9.3047 9.3047 9.3555 9.3555 9.6908 9.6908 11.3213 11.3213 11.3717 11.3717 k = 0.1900 0.1900-0.0000 ( 15885 PWs) bands (ev): -69.8718 -69.8718 -69.8658 -69.8658 -39.6484 -39.6484 -39.6361 -39.6361 -38.4898 -38.4898 -38.4689 -38.4689 -38.3894 -38.3894 -38.3867 -38.3867 -19.5799 -19.5799 -19.4415 -19.4415 -15.8590 -15.8590 -15.8411 -15.8411 -6.2064 -6.2064 -6.0309 -6.0309 -4.3761 -4.3761 -4.1993 -4.1993 -4.0720 -4.0720 -3.9481 -3.9481 -0.8259 -0.8259 -0.2720 -0.2720 2.3731 2.3731 2.4096 2.4096 2.4772 2.4772 2.5471 2.5471 2.7357 2.7357 2.9872 2.9872 5.1894 5.1894 5.8631 5.8631 6.0355 6.0355 6.1447 6.1447 6.4298 6.4298 6.8446 6.8446 7.3885 7.3885 7.9635 7.9635 8.1642 8.1642 8.2179 8.2179 8.4934 8.4934 8.5431 8.5431 9.2595 9.2595 9.3269 9.3269 9.3555 9.3555 9.7067 9.7067 11.3653 11.3653 11.3933 11.3933 k = 0.1800 0.1800-0.0000 ( 15887 PWs) bands (ev): -69.8720 -69.8720 -69.8658 -69.8658 -39.6486 -39.6486 -39.6358 -39.6358 -38.4902 -38.4902 -38.4684 -38.4684 -38.3895 -38.3895 -38.3867 -38.3867 -19.5856 -19.5856 -19.4416 -19.4416 -15.8545 -15.8545 -15.8363 -15.8363 -6.2043 -6.2043 -6.0302 -6.0302 -4.3726 -4.3726 -4.1990 -4.1990 -4.0667 -4.0667 -3.9477 -3.9477 -0.8512 -0.8512 -0.2816 -0.2816 2.3746 2.3746 2.3984 2.3984 2.4639 2.4639 2.5345 2.5345 2.7503 2.7503 2.9830 2.9830 5.1843 5.1843 5.8890 5.8890 6.0783 6.0783 6.1482 6.1482 6.4343 6.4343 6.8584 6.8584 7.3729 7.3729 7.9956 7.9956 8.1745 8.1745 8.2308 8.2308 8.5065 8.5065 8.5586 8.5586 9.2644 9.2644 9.3405 9.3405 9.3769 9.3769 9.7259 9.7259 11.4069 11.4069 11.4209 11.4209 k = 0.1700 0.1700-0.0000 ( 15879 PWs) bands (ev): -69.8716 -69.8716 -69.8658 -69.8658 -39.6489 -39.6489 -39.6356 -39.6356 -38.4906 -38.4906 -38.4679 -38.4679 -38.3896 -38.3896 -38.3866 -38.3866 -19.5911 -19.5911 -19.4417 -19.4417 -15.8501 -15.8501 -15.8316 -15.8316 -6.2020 -6.2020 -6.0297 -6.0297 -4.3688 -4.3688 -4.1984 -4.1984 -4.0615 -4.0615 -3.9480 -3.9480 -0.8756 -0.8756 -0.2912 -0.2912 2.3751 2.3751 2.3881 2.3881 2.4507 2.4507 2.5230 2.5230 2.7647 2.7647 2.9787 2.9787 5.1744 5.1744 5.9070 5.9070 6.1299 6.1299 6.1562 6.1562 6.4388 6.4388 6.8724 6.8724 7.3605 7.3605 8.0290 8.0290 8.1837 8.1837 8.2409 8.2409 8.5229 8.5229 8.5770 8.5770 9.2588 9.2588 9.3384 9.3384 9.4218 9.4218 9.7485 9.7485 11.4266 11.4266 11.4562 11.4562 k = 0.1600 0.1600-0.0000 ( 15863 PWs) bands (ev): -69.8714 -69.8714 -69.8650 -69.8650 -39.6491 -39.6491 -39.6353 -39.6353 -38.4910 -38.4910 -38.4675 -38.4675 -38.3896 -38.3896 -38.3866 -38.3866 -19.5964 -19.5964 -19.4418 -19.4418 -15.8459 -15.8459 -15.8270 -15.8270 -6.1995 -6.1995 -6.0295 -6.0295 -4.3648 -4.3648 -4.1973 -4.1973 -4.0564 -4.0564 -3.9490 -3.9490 -0.8990 -0.8990 -0.3006 -0.3006 2.3729 2.3729 2.3803 2.3803 2.4379 2.4379 2.5129 2.5129 2.7787 2.7787 2.9744 2.9744 5.1604 5.1604 5.9214 5.9214 6.1607 6.1607 6.1950 6.1950 6.4433 6.4433 6.8876 6.8876 7.3485 7.3485 8.0621 8.0621 8.1916 8.1916 8.2491 8.2491 8.5405 8.5405 8.5956 8.5956 9.2474 9.2474 9.3352 9.3352 9.4726 9.4726 9.7754 9.7754 11.4051 11.4051 11.4452 11.4452 k = 0.1500 0.1500-0.0000 ( 15857 PWs) bands (ev): -69.8711 -69.8711 -69.8650 -69.8650 -39.6493 -39.6493 -39.6351 -39.6351 -38.4914 -38.4914 -38.4670 -38.4670 -38.3897 -38.3897 -38.3865 -38.3865 -19.6014 -19.6014 -19.4419 -19.4419 -15.8418 -15.8418 -15.8227 -15.8227 -6.1969 -6.1969 -6.0294 -6.0294 -4.3608 -4.3608 -4.1957 -4.1957 -4.0515 -4.0515 -3.9507 -3.9507 -0.9213 -0.9213 -0.3097 -0.3097 2.3656 2.3656 2.3773 2.3773 2.4255 2.4255 2.5039 2.5039 2.7923 2.7923 2.9702 2.9702 5.1429 5.1429 5.9328 5.9328 6.1741 6.1741 6.2559 6.2559 6.4476 6.4476 6.9029 6.9029 7.3346 7.3346 8.0971 8.0971 8.1967 8.1967 8.2527 8.2527 8.5611 8.5611 8.6147 8.6147 9.2308 9.2308 9.3286 9.3286 9.5262 9.5262 9.8043 9.8043 11.3363 11.3363 11.4538 11.4538 k = 0.1400 0.1400-0.0000 ( 15853 PWs) bands (ev): -69.8713 -69.8713 -69.8646 -69.8646 -39.6495 -39.6495 -39.6348 -39.6348 -38.4917 -38.4917 -38.4666 -38.4666 -38.3898 -38.3898 -38.3865 -38.3865 -19.6062 -19.6062 -19.4419 -19.4419 -15.8379 -15.8379 -15.8186 -15.8186 -6.1942 -6.1942 -6.0295 -6.0295 -4.3568 -4.3568 -4.1936 -4.1936 -4.0468 -4.0468 -3.9532 -3.9532 -0.9424 -0.9424 -0.3186 -0.3186 2.3570 2.3570 2.3752 2.3752 2.4139 2.4139 2.4960 2.4960 2.8053 2.8053 2.9662 2.9662 5.1227 5.1227 5.9426 5.9426 6.1895 6.1895 6.3186 6.3186 6.4521 6.4521 6.9186 6.9186 7.3214 7.3214 8.1312 8.1312 8.2002 8.2002 8.2548 8.2548 8.5813 8.5813 8.6322 8.6322 9.2097 9.2097 9.3226 9.3226 9.5818 9.5818 9.8370 9.8370 11.2654 11.2654 11.4577 11.4577 k = 0.1300 0.1300-0.0000 ( 15845 PWs) bands (ev): -69.8703 -69.8703 -69.8650 -69.8650 -39.6497 -39.6497 -39.6346 -39.6346 -38.4921 -38.4921 -38.4662 -38.4662 -38.3898 -38.3898 -38.3864 -38.3864 -19.6108 -19.6108 -19.4420 -19.4420 -15.8342 -15.8342 -15.8147 -15.8147 -6.1915 -6.1915 -6.0299 -6.0299 -4.3528 -4.3528 -4.1908 -4.1908 -4.0423 -4.0423 -3.9563 -3.9563 -0.9624 -0.9624 -0.3272 -0.3272 2.3487 2.3487 2.3723 2.3723 2.4035 2.4035 2.4892 2.4892 2.8177 2.8177 2.9624 2.9624 5.1009 5.1009 5.9503 5.9503 6.2066 6.2066 6.3805 6.3805 6.4569 6.4569 6.9349 6.9349 7.3089 7.3089 8.1670 8.1670 8.2043 8.2043 8.2543 8.2543 8.6038 8.6038 8.6535 8.6535 9.1866 9.1866 9.3136 9.3136 9.6389 9.6389 9.8723 9.8723 11.1948 11.1948 11.4545 11.4545 k = 0.1200 0.1200-0.0000 ( 15853 PWs) bands (ev): -69.8709 -69.8709 -69.8650 -69.8650 -39.6499 -39.6499 -39.6344 -39.6344 -38.4924 -38.4924 -38.4659 -38.4659 -38.3899 -38.3899 -38.3864 -38.3864 -19.6151 -19.6151 -19.4421 -19.4421 -15.8307 -15.8307 -15.8110 -15.8110 -6.1887 -6.1887 -6.0303 -6.0303 -4.3490 -4.3490 -4.1874 -4.1874 -4.0382 -4.0382 -3.9601 -3.9601 -0.9810 -0.9810 -0.3353 -0.3353 2.3408 2.3408 2.3681 2.3681 2.3946 2.3946 2.4833 2.4833 2.8293 2.8293 2.9590 2.9590 5.0777 5.0777 5.9568 5.9568 6.2257 6.2257 6.4360 6.4360 6.4677 6.4677 6.9514 6.9514 7.2937 7.2937 8.1883 8.1883 8.2162 8.2162 8.2524 8.2524 8.6232 8.6232 8.6703 8.6703 9.1587 9.1587 9.3057 9.3057 9.6976 9.6976 9.9115 9.9115 11.1262 11.1262 11.4430 11.4430 k = 0.1100 0.1100-0.0000 ( 15861 PWs) bands (ev): -69.8712 -69.8712 -69.8652 -69.8652 -39.6501 -39.6501 -39.6342 -39.6342 -38.4927 -38.4927 -38.4655 -38.4655 -38.3899 -38.3899 -38.3864 -38.3864 -19.6191 -19.6191 -19.4421 -19.4421 -15.8274 -15.8274 -15.8076 -15.8076 -6.1859 -6.1859 -6.0309 -6.0309 -4.3455 -4.3455 -4.1833 -4.1833 -4.0344 -4.0344 -3.9645 -3.9645 -0.9984 -0.9984 -0.3430 -0.3430 2.3336 2.3336 2.3624 2.3624 2.3876 2.3876 2.4782 2.4782 2.8401 2.8401 2.9559 2.9559 5.0541 5.0541 5.9622 5.9622 6.2462 6.2462 6.4576 6.4576 6.5102 6.5102 6.9687 6.9687 7.2822 7.2822 8.1895 8.1895 8.2365 8.2365 8.2584 8.2584 8.6409 8.6409 8.6864 8.6864 9.1286 9.1286 9.2961 9.2961 9.7572 9.7572 9.9548 9.9548 11.0597 11.0597 11.4221 11.4221 k = 0.1000 0.1000-0.0000 ( 15869 PWs) bands (ev): -69.8717 -69.8717 -69.8651 -69.8651 -39.6503 -39.6503 -39.6340 -39.6340 -38.4930 -38.4930 -38.4652 -38.4652 -38.3900 -38.3900 -38.3863 -38.3863 -19.6228 -19.6228 -19.4422 -19.4422 -15.8244 -15.8244 -15.8044 -15.8044 -6.1831 -6.1831 -6.0316 -6.0316 -4.3422 -4.3422 -4.1785 -4.1785 -4.0310 -4.0310 -3.9694 -3.9694 -1.0144 -1.0144 -0.3502 -0.3502 2.3269 2.3269 2.3556 2.3556 2.3822 2.3822 2.4738 2.4738 2.8499 2.8499 2.9533 2.9533 5.0311 5.0311 5.9666 5.9666 6.2667 6.2667 6.4641 6.4641 6.5655 6.5655 6.9865 6.9865 7.2693 7.2693 8.1868 8.1868 8.2391 8.2391 8.2885 8.2885 8.6573 8.6573 8.7003 8.7003 9.0957 9.0957 9.2872 9.2872 9.8171 9.8171 10.0011 10.0011 10.9973 10.9973 11.3914 11.3914 k = 0.0900 0.0900-0.0000 ( 15853 PWs) bands (ev): -69.8715 -69.8715 -69.8644 -69.8644 -39.6504 -39.6504 -39.6339 -39.6339 -38.4932 -38.4932 -38.4649 -38.4649 -38.3900 -38.3900 -38.3863 -38.3863 -19.6262 -19.6262 -19.4423 -19.4423 -15.8216 -15.8216 -15.8015 -15.8015 -6.1805 -6.1805 -6.0324 -6.0324 -4.3392 -4.3392 -4.1732 -4.1732 -4.0280 -4.0280 -3.9746 -3.9746 -1.0290 -1.0290 -0.3567 -0.3567 2.3209 2.3209 2.3484 2.3484 2.3779 2.3779 2.4700 2.4700 2.8586 2.8586 2.9513 2.9513 5.0084 5.0084 5.9711 5.9711 6.2878 6.2878 6.4714 6.4714 6.6188 6.6188 7.0063 7.0063 7.2594 7.2594 8.1803 8.1803 8.2356 8.2356 8.3286 8.3286 8.6735 8.6735 8.7158 8.7158 9.0657 9.0657 9.2793 9.2793 9.8797 9.8797 10.0529 10.0529 10.9388 10.9388 11.3513 11.3513 k = 0.0800 0.0800-0.0000 ( 15851 PWs) bands (ev): -69.8715 -69.8715 -69.8643 -69.8643 -39.6506 -39.6506 -39.6337 -39.6337 -38.4935 -38.4935 -38.4647 -38.4647 -38.3900 -38.3900 -38.3862 -38.3862 -19.6293 -19.6293 -19.4423 -19.4423 -15.8190 -15.8190 -15.7989 -15.7989 -6.1779 -6.1779 -6.0332 -6.0332 -4.3366 -4.3366 -4.1672 -4.1672 -4.0257 -4.0257 -3.9800 -3.9800 -1.0421 -1.0421 -0.3627 -0.3627 2.3154 2.3154 2.3413 2.3413 2.3743 2.3743 2.4668 2.4668 2.8661 2.8661 2.9500 2.9500 4.9871 4.9871 5.9733 5.9733 6.3067 6.3067 6.4781 6.4781 6.6679 6.6679 7.0262 7.0262 7.2502 7.2502 8.1724 8.1724 8.2318 8.2318 8.3680 8.3680 8.6882 8.6882 8.7302 8.7302 9.0320 9.0320 9.2700 9.2700 9.9411 9.9411 10.1073 10.1073 10.8851 10.8851 11.3029 11.3029 k = 0.0700 0.0700-0.0000 ( 15851 PWs) bands (ev): -69.8715 -69.8715 -69.8643 -69.8643 -39.6507 -39.6507 -39.6336 -39.6336 -38.4937 -38.4937 -38.4644 -38.4644 -38.3900 -38.3900 -38.3862 -38.3862 -19.6320 -19.6320 -19.4423 -19.4423 -15.8168 -15.8168 -15.7966 -15.7966 -6.1755 -6.1755 -6.0340 -6.0340 -4.3344 -4.3344 -4.1608 -4.1608 -4.0241 -4.0241 -3.9853 -3.9853 -1.0537 -1.0537 -0.3681 -0.3681 2.3106 2.3106 2.3347 2.3347 2.3711 2.3711 2.4640 2.4640 2.8723 2.8723 2.9493 2.9493 4.9673 4.9673 5.9757 5.9757 6.3235 6.3235 6.4837 6.4837 6.7116 6.7116 7.0470 7.0470 7.2411 7.2411 8.1636 8.1636 8.2287 8.2287 8.4076 8.4076 8.7017 8.7017 8.7435 8.7435 8.9974 8.9974 9.2607 9.2607 9.9995 9.9995 10.1648 10.1648 10.8368 10.8368 11.2479 11.2479 k = 0.0600 0.0600-0.0000 ( 15835 PWs) bands (ev): -69.8711 -69.8711 -69.8638 -69.8638 -39.6508 -39.6508 -39.6335 -39.6335 -38.4938 -38.4938 -38.4642 -38.4642 -38.3901 -38.3901 -38.3862 -38.3862 -19.6344 -19.6344 -19.4424 -19.4424 -15.8148 -15.8148 -15.7946 -15.7946 -6.1734 -6.1734 -6.0349 -6.0349 -4.3325 -4.3325 -4.1542 -4.1542 -4.0236 -4.0236 -3.9902 -3.9902 -1.0639 -1.0639 -0.3727 -0.3727 2.3065 2.3065 2.3289 2.3289 2.3684 2.3684 2.4617 2.4617 2.8773 2.8773 2.9493 2.9493 4.9495 4.9495 5.9784 5.9784 6.3391 6.3391 6.4915 6.4915 6.7497 6.7497 7.0685 7.0685 7.2370 7.2370 8.1547 8.1547 8.2265 8.2265 8.4483 8.4483 8.7131 8.7131 8.7548 8.7548 8.9638 8.9638 9.2495 9.2495 10.0586 10.0586 10.2269 10.2269 10.7944 10.7944 11.1888 11.1888 k = 0.0500 0.0500-0.0000 ( 15837 PWs) bands (ev): -69.8717 -69.8717 -69.8633 -69.8633 -39.6509 -39.6509 -39.6334 -39.6334 -38.4940 -38.4940 -38.4641 -38.4641 -38.3901 -38.3901 -38.3862 -38.3862 -19.6364 -19.6364 -19.4424 -19.4424 -15.8131 -15.8131 -15.7928 -15.7928 -6.1714 -6.1714 -6.0356 -6.0356 -4.3309 -4.3309 -4.1475 -4.1475 -4.0242 -4.0242 -3.9942 -3.9942 -1.0725 -1.0725 -0.3767 -0.3767 2.3030 2.3030 2.3238 2.3238 2.3660 2.3660 2.4598 2.4598 2.8810 2.8810 2.9498 2.9498 4.9339 4.9339 5.9799 5.9799 6.3517 6.3517 6.4997 6.4997 6.7810 6.7810 7.0891 7.0891 7.2303 7.2303 8.1450 8.1450 8.2231 8.2231 8.4868 8.4868 8.7193 8.7193 8.7619 8.7619 8.9276 8.9276 9.2424 9.2424 10.1154 10.1154 10.2906 10.2906 10.7579 10.7579 11.1281 11.1281 k = 0.0400 0.0400-0.0000 ( 15829 PWs) bands (ev): -69.8720 -69.8720 -69.8625 -69.8625 -39.6509 -39.6509 -39.6333 -39.6333 -38.4941 -38.4941 -38.4639 -38.4639 -38.3901 -38.3901 -38.3862 -38.3862 -19.6381 -19.6381 -19.4425 -19.4425 -15.8117 -15.8117 -15.7914 -15.7914 -6.1698 -6.1698 -6.0363 -6.0363 -4.3297 -4.3297 -4.1411 -4.1411 -4.0262 -4.0262 -3.9969 -3.9969 -1.0796 -1.0796 -0.3800 -0.3800 2.3001 2.3001 2.3196 2.3196 2.3641 2.3641 2.4582 2.4582 2.8837 2.8837 2.9507 2.9507 4.9206 4.9206 5.9818 5.9818 6.3616 6.3616 6.5074 6.5074 6.8060 6.8060 7.1088 7.1088 7.2248 7.2248 8.1377 8.1377 8.2195 8.2195 8.5262 8.5262 8.7263 8.7263 8.7673 8.7673 8.8945 8.8945 9.2363 9.2363 10.1680 10.1680 10.3545 10.3545 10.7284 10.7284 11.0688 11.0688 k = 0.0300 0.0300-0.0000 ( 15821 PWs) bands (ev): -69.8723 -69.8723 -69.8618 -69.8618 -39.6510 -39.6510 -39.6332 -39.6332 -38.4942 -38.4942 -38.4638 -38.4638 -38.3901 -38.3901 -38.3862 -38.3862 -19.6394 -19.6394 -19.4425 -19.4425 -15.8106 -15.8106 -15.7903 -15.7903 -6.1685 -6.1685 -6.0369 -6.0369 -4.3288 -4.3288 -4.1352 -4.1352 -4.0291 -4.0291 -3.9985 -3.9985 -1.0851 -1.0851 -0.3826 -0.3826 2.2979 2.2979 2.3163 2.3163 2.3625 2.3625 2.4570 2.4570 2.8855 2.8855 2.9517 2.9517 4.9102 4.9102 5.9839 5.9839 6.3688 6.3688 6.5138 6.5138 6.8250 6.8250 7.1259 7.1259 7.2199 7.2199 8.1315 8.1315 8.2171 8.2171 8.5640 8.5640 8.7313 8.7313 8.7690 8.7690 8.8638 8.8638 9.2337 9.2337 10.2141 10.2141 10.4157 10.4157 10.7051 10.7051 11.0137 11.0137 k = 0.0200 0.0200-0.0000 ( 15811 PWs) bands (ev): -69.8723 -69.8723 -69.8612 -69.8612 -39.6510 -39.6510 -39.6332 -39.6332 -38.4942 -38.4942 -38.4637 -38.4637 -38.3901 -38.3901 -38.3862 -38.3862 -19.6404 -19.6404 -19.4425 -19.4425 -15.8099 -15.8099 -15.7895 -15.7895 -6.1675 -6.1675 -6.0373 -6.0373 -4.3281 -4.3281 -4.1305 -4.1305 -4.0320 -4.0320 -3.9993 -3.9993 -1.0890 -1.0890 -0.3844 -0.3844 2.2963 2.2963 2.3139 2.3139 2.3613 2.3613 2.4561 2.4561 2.8866 2.8866 2.9526 2.9526 4.9026 4.9026 5.9849 5.9849 6.3742 6.3742 6.5194 6.5194 6.8382 6.8382 7.1393 7.1393 7.2148 7.2148 8.1263 8.1263 8.2150 8.2150 8.5994 8.5994 8.7383 8.7383 8.7636 8.7636 8.8418 8.8418 9.2322 9.2322 10.2520 10.2520 10.4712 10.4712 10.6886 10.6886 10.9670 10.9670 k = 0.0100 0.0100-0.0000 ( 15815 PWs) bands (ev): -69.8726 -69.8726 -69.8612 -69.8612 -39.6510 -39.6510 -39.6332 -39.6332 -38.4942 -38.4942 -38.4637 -38.4637 -38.3901 -38.3901 -38.3862 -38.3862 -19.6409 -19.6409 -19.4425 -19.4425 -15.8094 -15.8094 -15.7890 -15.7890 -6.1669 -6.1669 -6.0375 -6.0375 -4.3277 -4.3277 -4.1273 -4.1273 -4.0342 -4.0342 -3.9996 -3.9996 -1.0914 -1.0914 -0.3855 -0.3855 2.2953 2.2953 2.3125 2.3125 2.3607 2.3607 2.4556 2.4556 2.8872 2.8872 2.9532 2.9532 4.8979 4.8979 5.9854 5.9854 6.3766 6.3766 6.5220 6.5220 6.8457 6.8457 7.1476 7.1476 7.2130 7.2130 8.1226 8.1226 8.2129 8.2129 8.6284 8.6284 8.7407 8.7407 8.7493 8.7493 8.8295 8.8295 9.2298 9.2298 10.2760 10.2760 10.5108 10.5108 10.6786 10.6786 10.9338 10.9338 k = 0.0000 0.0000 0.0000 ( 15829 PWs) bands (ev): -69.8724 -69.8724 -69.8622 -69.8622 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4637 -38.4637 -38.3901 -38.3901 -38.3862 -38.3862 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1667 -6.1667 -6.0376 -6.0376 -4.3276 -4.3276 -4.1262 -4.1262 -4.0350 -4.0350 -3.9997 -3.9997 -1.0922 -1.0922 -0.3859 -0.3859 2.2950 2.2950 2.3120 2.3120 2.3604 2.3604 2.4554 2.4554 2.8874 2.8874 2.9534 2.9534 4.8963 4.8963 5.9846 5.9846 6.3756 6.3756 6.5208 6.5208 6.8483 6.8483 7.1505 7.1505 7.2125 7.2125 8.1204 8.1204 8.2130 8.2130 8.6408 8.6408 8.7406 8.7406 8.7430 8.7430 8.8267 8.8267 9.2265 9.2265 10.2816 10.2816 10.5233 10.5233 10.6749 10.6749 10.9213 10.9213 k = 0.0000 0.0000 0.0000 ( 15829 PWs) bands (ev): -69.8724 -69.8724 -69.8622 -69.8622 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4637 -38.4637 -38.3901 -38.3901 -38.3862 -38.3862 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1667 -6.1667 -6.0376 -6.0376 -4.3276 -4.3276 -4.1262 -4.1262 -4.0350 -4.0350 -3.9997 -3.9997 -1.0922 -1.0922 -0.3859 -0.3859 2.2950 2.2950 2.3120 2.3120 2.3604 2.3604 2.4554 2.4554 2.8874 2.8874 2.9534 2.9534 4.8963 4.8963 5.9846 5.9846 6.3756 6.3756 6.5208 6.5208 6.8483 6.8483 7.1505 7.1505 7.2125 7.2125 8.1204 8.1204 8.2130 8.2130 8.6408 8.6408 8.7406 8.7406 8.7430 8.7430 8.8267 8.8267 9.2265 9.2265 10.2816 10.2816 10.5233 10.5233 10.6749 10.6749 10.9213 10.9213 k = 0.0000 0.0000 0.0134 ( 15805 PWs) bands (ev): -69.8720 -69.8720 -69.8612 -69.8612 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4637 -38.4637 -38.3901 -38.3901 -38.3861 -38.3861 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1667 -6.1667 -6.0376 -6.0376 -4.3276 -4.3276 -4.1261 -4.1261 -4.0351 -4.0351 -3.9997 -3.9997 -1.0921 -1.0921 -0.3858 -0.3858 2.2950 2.2950 2.3113 2.3113 2.3604 2.3604 2.4554 2.4554 2.8874 2.8874 2.9534 2.9534 4.8985 4.8985 5.9843 5.9843 6.3773 6.3773 6.5231 6.5231 6.8487 6.8487 7.1509 7.1509 7.2127 7.2127 8.1215 8.1215 8.2154 8.2154 8.6414 8.6414 8.7425 8.7425 8.7433 8.7433 8.8283 8.8283 9.2288 9.2288 10.2845 10.2845 10.5260 10.5260 10.6701 10.6701 10.9251 10.9251 k = 0.0000 0.0000 0.0268 ( 15801 PWs) bands (ev): -69.8717 -69.8717 -69.8612 -69.8612 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4637 -38.4637 -38.3901 -38.3901 -38.3861 -38.3861 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1667 -6.1667 -6.0377 -6.0377 -4.3276 -4.3276 -4.1258 -4.1258 -4.0355 -4.0355 -3.9997 -3.9997 -1.0920 -1.0920 -0.3854 -0.3854 2.2950 2.2950 2.3092 2.3092 2.3604 2.3604 2.4554 2.4554 2.8874 2.8874 2.9534 2.9534 4.9038 4.9038 5.9806 5.9806 6.3765 6.3765 6.5230 6.5230 6.8494 6.8494 7.1516 7.1516 7.2132 7.2132 8.1226 8.1226 8.2136 8.2136 8.6420 8.6420 8.7437 8.7437 8.7448 8.7448 8.8302 8.8302 9.2288 9.2288 10.2841 10.2841 10.5256 10.5256 10.6556 10.6556 10.9365 10.9365 k = 0.0000 0.0000 0.0402 ( 15817 PWs) bands (ev): -69.8719 -69.8719 -69.8619 -69.8619 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4637 -38.4637 -38.3901 -38.3901 -38.3861 -38.3861 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1666 -6.1666 -6.0378 -6.0378 -4.3276 -4.3276 -4.1253 -4.1253 -4.0360 -4.0360 -3.9997 -3.9997 -1.0919 -1.0919 -0.3848 -0.3848 2.2950 2.2950 2.3057 2.3057 2.3604 2.3604 2.4554 2.4554 2.8874 2.8874 2.9534 2.9534 4.9125 4.9125 5.9747 5.9747 6.3744 6.3744 6.5215 6.5215 6.8499 6.8499 7.1519 7.1519 7.2133 7.2133 8.1191 8.1191 8.2124 8.2124 8.6431 8.6431 8.7409 8.7409 8.7449 8.7449 8.8299 8.8299 9.2301 9.2301 10.2819 10.2819 10.5235 10.5235 10.6318 10.6318 10.9552 10.9552 k = 0.0000 0.0000 0.0536 ( 15821 PWs) bands (ev): -69.8727 -69.8727 -69.8615 -69.8615 -39.6511 -39.6511 -39.6332 -39.6332 -38.4943 -38.4943 -38.4637 -38.4637 -38.3901 -38.3901 -38.3861 -38.3861 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1665 -6.1665 -6.0379 -6.0379 -4.3276 -4.3276 -4.1246 -4.1246 -4.0367 -4.0367 -3.9997 -3.9997 -1.0917 -1.0917 -0.3840 -0.3840 2.2949 2.2949 2.3011 2.3011 2.3604 2.3604 2.4554 2.4554 2.8874 2.8874 2.9534 2.9534 4.9245 4.9245 5.9664 5.9664 6.3732 6.3732 6.5217 6.5217 6.8500 6.8500 7.1517 7.1517 7.2119 7.2119 8.1253 8.1253 8.2118 8.2118 8.6446 8.6446 8.7381 8.7381 8.7418 8.7418 8.8269 8.8269 9.2301 9.2301 10.2816 10.2816 10.5232 10.5232 10.6066 10.6066 10.9809 10.9809 k = 0.0000 0.0000 0.0671 ( 15837 PWs) bands (ev): -69.8717 -69.8717 -69.8634 -69.8634 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4637 -38.4637 -38.3901 -38.3901 -38.3861 -38.3861 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1664 -6.1664 -6.0380 -6.0380 -4.3276 -4.3276 -4.1237 -4.1237 -4.0377 -4.0377 -3.9997 -3.9997 -1.0914 -1.0914 -0.3831 -0.3831 2.2949 2.2949 2.2954 2.2954 2.3604 2.3604 2.4553 2.4553 2.8873 2.8873 2.9535 2.9535 4.9397 4.9397 5.9544 5.9544 6.3686 6.3686 6.5184 6.5184 6.8517 6.8517 7.1533 7.1533 7.2128 7.2128 8.1219 8.1219 8.2116 8.2116 8.6456 8.6456 8.7411 8.7411 8.7469 8.7469 8.8315 8.8315 9.2249 9.2249 10.2766 10.2766 10.5184 10.5184 10.5758 10.5758 11.0130 11.0130 k = 0.0000 0.0000 0.0805 ( 15853 PWs) bands (ev): -69.8721 -69.8721 -69.8639 -69.8639 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4637 -38.4637 -38.3902 -38.3902 -38.3861 -38.3861 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1663 -6.1663 -6.0382 -6.0382 -4.3276 -4.3276 -4.1227 -4.1227 -4.0387 -4.0387 -3.9997 -3.9997 -1.0911 -1.0911 -0.3819 -0.3819 2.2889 2.2889 2.2949 2.2949 2.3604 2.3604 2.4553 2.4553 2.8873 2.8873 2.9535 2.9535 4.9569 4.9569 5.9417 5.9417 6.3655 6.3655 6.5168 6.5168 6.8523 6.8523 7.1535 7.1535 7.2129 7.2129 8.1236 8.1236 8.2084 8.2084 8.6481 8.6481 8.7407 8.7407 8.7450 8.7450 8.8299 8.8299 9.2244 9.2244 10.2740 10.2740 10.5150 10.5150 10.5455 10.5455 11.0512 11.0512 k = 0.0000 0.0000 0.0939 ( 15861 PWs) bands (ev): -69.8726 -69.8726 -69.8639 -69.8639 -39.6511 -39.6511 -39.6332 -39.6332 -38.4943 -38.4943 -38.4637 -38.4637 -38.3902 -38.3902 -38.3862 -38.3862 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1662 -6.1662 -6.0383 -6.0383 -4.3276 -4.3276 -4.1215 -4.1215 -4.0400 -4.0400 -3.9997 -3.9997 -1.0907 -1.0907 -0.3807 -0.3807 2.2819 2.2819 2.2948 2.2948 2.3604 2.3604 2.4553 2.4553 2.8873 2.8873 2.9535 2.9535 4.9764 4.9764 5.9275 5.9275 6.3633 6.3633 6.5164 6.5164 6.8530 6.8530 7.1538 7.1538 7.2111 7.2111 8.1270 8.1270 8.2058 8.2058 8.6511 8.6511 8.7404 8.7404 8.7436 8.7436 8.8287 8.8287 9.2244 9.2244 10.2728 10.2728 10.5063 10.5063 10.5222 10.5222 11.0946 11.0946 k = 0.0000 0.0000 0.1073 ( 15857 PWs) bands (ev): -69.8724 -69.8724 -69.8639 -69.8639 -39.6511 -39.6511 -39.6332 -39.6332 -38.4943 -38.4943 -38.4637 -38.4637 -38.3902 -38.3902 -38.3861 -38.3861 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1661 -6.1661 -6.0385 -6.0385 -4.3276 -4.3276 -4.1203 -4.1203 -4.0413 -4.0413 -3.9997 -3.9997 -1.0904 -1.0904 -0.3794 -0.3794 2.2745 2.2745 2.2948 2.2948 2.3603 2.3603 2.4553 2.4553 2.8873 2.8873 2.9535 2.9535 4.9980 4.9980 5.9117 5.9117 6.3609 6.3609 6.5160 6.5160 6.8543 6.8543 7.1547 7.1547 7.2113 7.2113 8.1307 8.1307 8.2059 8.2059 8.6546 8.6546 8.7405 8.7405 8.7447 8.7447 8.8295 8.8295 9.2245 9.2245 10.2717 10.2717 10.4804 10.4804 10.5167 10.5167 11.1426 11.1426 k = 0.0000 0.0000 0.1207 ( 15829 PWs) bands (ev): -69.8714 -69.8714 -69.8632 -69.8632 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4637 -38.4637 -38.3901 -38.3901 -38.3861 -38.3861 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1660 -6.1660 -6.0387 -6.0387 -4.3276 -4.3276 -4.1189 -4.1189 -4.0427 -4.0427 -3.9997 -3.9997 -1.0900 -1.0900 -0.3780 -0.3780 2.2670 2.2670 2.2948 2.2948 2.3603 2.3603 2.4553 2.4553 2.8872 2.8872 2.9535 2.9535 5.0205 5.0205 5.8949 5.8949 6.3594 6.3594 6.5166 6.5166 6.8557 6.8557 7.1560 7.1560 7.2159 7.2159 8.1374 8.1374 8.2064 8.2064 8.6586 8.6586 8.7444 8.7444 8.7466 8.7466 8.8316 8.8316 9.2286 9.2286 10.2718 10.2718 10.4527 10.4527 10.5160 10.5160 11.1945 11.1945 k = 0.0000 0.0000 0.1341 ( 15793 PWs) bands (ev): -69.8697 -69.8697 -69.8627 -69.8627 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4636 -38.4636 -38.3901 -38.3901 -38.3861 -38.3861 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1658 -6.1658 -6.0388 -6.0388 -4.3276 -4.3276 -4.1176 -4.1176 -4.0441 -4.0441 -3.9997 -3.9997 -1.0895 -1.0895 -0.3767 -0.3767 2.2596 2.2596 2.2947 2.2947 2.3603 2.3603 2.4552 2.4552 2.8872 2.8872 2.9536 2.9536 5.0439 5.0439 5.8777 5.8777 6.3587 6.3587 6.5179 6.5179 6.8578 6.8578 7.1582 7.1582 7.2196 7.2196 8.1392 8.1392 8.2081 8.2081 8.6629 8.6629 8.7486 8.7486 8.7533 8.7533 8.8377 8.8377 9.2312 9.2312 10.2732 10.2732 10.4261 10.4261 10.5168 10.5168 11.2247 11.2247 k = 0.0000 0.0000 0.1475 ( 15801 PWs) bands (ev): -69.8696 -69.8696 -69.8632 -69.8632 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4636 -38.4636 -38.3902 -38.3902 -38.3861 -38.3861 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1657 -6.1657 -6.0390 -6.0390 -4.3276 -4.3276 -4.1162 -4.1162 -4.0455 -4.0455 -3.9997 -3.9997 -1.0892 -1.0892 -0.3755 -0.3755 2.2527 2.2527 2.2947 2.2947 2.3603 2.3603 2.4552 2.4552 2.8872 2.8872 2.9536 2.9536 5.0665 5.0665 5.8599 5.8599 6.3559 6.3559 6.5165 6.5165 6.8588 6.8588 7.1589 7.1589 7.2197 7.2197 8.1407 8.1407 8.2069 8.2069 8.6671 8.6671 8.7486 8.7486 8.7534 8.7534 8.8378 8.8378 9.2312 9.2312 10.2708 10.2708 10.4020 10.4020 10.5144 10.5144 11.2405 11.2405 k = 0.0000 0.0000 0.1609 ( 15792 PWs) bands (ev): -69.8691 -69.8691 -69.8632 -69.8632 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4636 -38.4636 -38.3902 -38.3902 -38.3861 -38.3861 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1656 -6.1656 -6.0392 -6.0392 -4.3276 -4.3276 -4.1150 -4.1150 -4.0468 -4.0468 -3.9997 -3.9997 -1.0889 -1.0889 -0.3743 -0.3743 2.2465 2.2465 2.2947 2.2947 2.3603 2.3603 2.4552 2.4552 2.8872 2.8872 2.9536 2.9536 5.0880 5.0880 5.8430 5.8430 6.3541 6.3541 6.5162 6.5162 6.8599 6.8599 7.1598 7.1598 7.2199 7.2199 8.1440 8.1440 8.2069 8.2069 8.6713 8.6713 8.7526 8.7526 8.7548 8.7548 8.8395 8.8395 9.2312 9.2312 10.2699 10.2699 10.3810 10.3810 10.5134 10.5134 11.2548 11.2548 k = 0.0000 0.0000 0.1744 ( 15796 PWs) bands (ev): -69.8693 -69.8693 -69.8632 -69.8632 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4636 -38.4636 -38.3902 -38.3902 -38.3861 -38.3861 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1655 -6.1655 -6.0393 -6.0393 -4.3276 -4.3276 -4.1139 -4.1139 -4.0480 -4.0480 -3.9997 -3.9997 -1.0886 -1.0886 -0.3733 -0.3733 2.2410 2.2410 2.2946 2.2946 2.3602 2.3602 2.4552 2.4552 2.8872 2.8872 2.9536 2.9536 5.1073 5.1073 5.8274 5.8274 6.3526 6.3526 6.5159 6.5159 6.8608 6.8608 7.1604 7.1604 7.2194 7.2194 8.1468 8.1468 8.2044 8.2044 8.6751 8.6751 8.7508 8.7508 8.7552 8.7552 8.8396 8.8396 9.2313 9.2313 10.2692 10.2692 10.3634 10.3634 10.5126 10.5126 11.2666 11.2666 k = 0.0000 0.0000 0.1878 ( 15788 PWs) bands (ev): -69.8686 -69.8686 -69.8634 -69.8634 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4636 -38.4636 -38.3901 -38.3901 -38.3860 -38.3860 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1655 -6.1655 -6.0394 -6.0394 -4.3276 -4.3276 -4.1129 -4.1129 -4.0490 -4.0490 -3.9997 -3.9997 -1.0884 -1.0884 -0.3725 -0.3725 2.2367 2.2367 2.2946 2.2946 2.3602 2.3602 2.4552 2.4552 2.8871 2.8871 2.9536 2.9536 5.1244 5.1244 5.8134 5.8134 6.3518 6.3518 6.5162 6.5162 6.8619 6.8619 7.1613 7.1613 7.2196 7.2196 8.1485 8.1485 8.2074 8.2074 8.6777 8.6777 8.7513 8.7513 8.7576 8.7576 8.8417 8.8417 9.2276 9.2276 10.2693 10.2693 10.3493 10.3493 10.5126 10.5126 11.2760 11.2760 k = 0.0000 0.0000 0.2012 ( 15788 PWs) bands (ev): -69.8693 -69.8693 -69.8627 -69.8627 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4636 -38.4636 -38.3901 -38.3901 -38.3860 -38.3860 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1654 -6.1654 -6.0395 -6.0395 -4.3276 -4.3276 -4.1122 -4.1122 -4.0497 -4.0497 -3.9997 -3.9997 -1.0882 -1.0882 -0.3719 -0.3719 2.2334 2.2334 2.2946 2.2946 2.3602 2.3602 2.4551 2.4551 2.8871 2.8871 2.9536 2.9536 5.1374 5.1374 5.8036 5.8036 6.3522 6.3522 6.5175 6.5175 6.8616 6.8616 7.1606 7.1606 7.2167 7.2167 8.1507 8.1507 8.2100 8.2100 8.6806 8.6806 8.7487 8.7487 8.7530 8.7530 8.8376 8.8376 9.2314 9.2314 10.2709 10.2709 10.3391 10.3391 10.5139 10.5139 11.2828 11.2828 k = 0.0000 0.0000 0.2146 ( 15808 PWs) bands (ev): -69.8698 -69.8698 -69.8634 -69.8634 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4636 -38.4636 -38.3902 -38.3902 -38.3861 -38.3861 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1654 -6.1654 -6.0395 -6.0395 -4.3276 -4.3276 -4.1117 -4.1117 -4.0502 -4.0502 -3.9997 -3.9997 -1.0881 -1.0881 -0.3715 -0.3715 2.2314 2.2314 2.2946 2.2946 2.3602 2.3602 2.4551 2.4551 2.8871 2.8871 2.9537 2.9537 5.1453 5.1453 5.7964 5.7964 6.3506 6.3506 6.5163 6.5163 6.8616 6.8616 7.1603 7.1603 7.2148 7.2148 8.1489 8.1489 8.2094 8.2094 8.6815 8.6815 8.7475 8.7475 8.7509 8.7509 8.8357 8.8357 9.2313 9.2313 10.2690 10.2690 10.3329 10.3329 10.5121 10.5121 11.2854 11.2854 k = 0.0000 0.0000 0.2280 ( 15828 PWs) bands (ev): -69.8698 -69.8698 -69.8646 -69.8646 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4636 -38.4636 -38.3902 -38.3902 -38.3861 -38.3861 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1653 -6.1653 -6.0395 -6.0395 -4.3276 -4.3276 -4.1116 -4.1116 -4.0503 -4.0503 -3.9997 -3.9997 -1.0881 -1.0881 -0.3714 -0.3714 2.2307 2.2307 2.2946 2.2946 2.3602 2.3602 2.4551 2.4551 2.8871 2.8871 2.9537 2.9537 5.1480 5.1480 5.7934 5.7934 6.3473 6.3473 6.5124 6.5124 6.8617 6.8617 7.1603 7.1603 7.2148 7.2148 8.1504 8.1504 8.2092 8.2092 8.6814 8.6814 8.7475 8.7475 8.7509 8.7509 8.8357 8.8357 9.2294 9.2294 10.2638 10.2638 10.3309 10.3309 10.5074 10.5074 11.2868 11.2868 k = 0.0000 0.0000 0.2280 ( 15828 PWs) bands (ev): -69.8698 -69.8698 -69.8646 -69.8646 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4636 -38.4636 -38.3902 -38.3902 -38.3861 -38.3861 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1653 -6.1653 -6.0395 -6.0395 -4.3276 -4.3276 -4.1116 -4.1116 -4.0503 -4.0503 -3.9997 -3.9997 -1.0881 -1.0881 -0.3714 -0.3714 2.2307 2.2307 2.2946 2.2946 2.3602 2.3602 2.4551 2.4551 2.8871 2.8871 2.9537 2.9537 5.1480 5.1480 5.7934 5.7934 6.3473 6.3473 6.5124 6.5124 6.8617 6.8617 7.1603 7.1603 7.2148 7.2148 8.1504 8.1504 8.2092 8.2092 8.6814 8.6814 8.7475 8.7475 8.7509 8.7509 8.8357 8.8357 9.2294 9.2294 10.2638 10.2638 10.3309 10.3309 10.5074 10.5074 11.2868 11.2868 k = 0.0000 0.0139 0.2280 ( 15808 PWs) bands (ev): -69.8698 -69.8698 -69.8634 -69.8634 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4637 -38.4637 -38.3902 -38.3902 -38.3861 -38.3861 -19.6409 -19.6409 -19.4425 -19.4425 -15.8094 -15.8094 -15.7890 -15.7890 -6.1655 -6.1655 -6.0394 -6.0394 -4.3278 -4.3278 -4.1130 -4.1130 -4.0492 -4.0492 -3.9996 -3.9996 -1.0873 -1.0873 -0.3711 -0.3711 2.2314 2.2314 2.2949 2.2949 2.3604 2.3604 2.4553 2.4553 2.8870 2.8870 2.9535 2.9535 5.1483 5.1483 5.7944 5.7944 6.3495 6.3495 6.5151 6.5151 6.8594 6.8594 7.1577 7.1577 7.2153 7.2153 8.1513 8.1513 8.2096 8.2096 8.6723 8.6723 8.7470 8.7470 8.7579 8.7579 8.8370 8.8370 9.2322 9.2322 10.2360 10.2360 10.3480 10.3480 10.5260 10.5260 11.2910 11.2910 k = 0.0000 0.0278 0.2280 ( 15806 PWs) bands (ev): -69.8694 -69.8694 -69.8636 -69.8636 -39.6511 -39.6511 -39.6331 -39.6331 -38.4942 -38.4942 -38.4637 -38.4637 -38.3902 -38.3902 -38.3861 -38.3861 -19.6404 -19.6404 -19.4425 -19.4425 -15.8098 -15.8098 -15.7895 -15.7895 -6.1661 -6.1661 -6.0392 -6.0392 -4.3282 -4.3282 -4.1169 -4.1169 -4.0460 -4.0460 -3.9993 -3.9993 -1.0850 -1.0850 -0.3703 -0.3703 2.2335 2.2335 2.2959 2.2959 2.3611 2.3611 2.4558 2.4558 2.8867 2.8867 2.9532 2.9532 5.1492 5.1492 5.7951 5.7951 6.3469 6.3469 6.5120 6.5120 6.8527 6.8527 7.1503 7.1503 7.2178 7.2178 8.1545 8.1545 8.2107 8.2107 8.6512 8.6512 8.7459 8.7459 8.7717 8.7717 8.8437 8.8437 9.2331 9.2331 10.1771 10.1771 10.3633 10.3633 10.5648 10.5648 11.3025 11.3025 k = 0.0000 0.0417 0.2280 ( 15792 PWs) bands (ev): -69.8689 -69.8689 -69.8633 -69.8633 -39.6510 -39.6510 -39.6332 -39.6332 -38.4942 -38.4942 -38.4638 -38.4638 -38.3901 -38.3901 -38.3860 -38.3860 -19.6395 -19.6395 -19.4425 -19.4425 -15.8106 -15.8106 -15.7902 -15.7902 -6.1671 -6.1671 -6.0387 -6.0387 -4.3290 -4.3290 -4.1226 -4.1226 -4.0416 -4.0416 -3.9988 -3.9988 -1.0811 -1.0811 -0.3690 -0.3690 2.2370 2.2370 2.2975 2.2975 2.3622 2.3622 2.4567 2.4567 2.8860 2.8860 2.9526 2.9526 5.1506 5.1506 5.7955 5.7955 6.3437 6.3437 6.5089 6.5089 6.8414 6.8414 7.1388 7.1388 7.2227 7.2227 8.1600 8.1600 8.2116 8.2116 8.6265 8.6265 8.7407 8.7407 8.7822 8.7822 8.8577 8.8577 9.2405 9.2405 10.1132 10.1132 10.3684 10.3684 10.6204 10.6204 11.3209 11.3209 k = 0.0000 0.0556 0.2280 ( 15810 PWs) bands (ev): -69.8695 -69.8695 -69.8638 -69.8638 -39.6510 -39.6510 -39.6332 -39.6332 -38.4941 -38.4941 -38.4639 -38.4639 -38.3901 -38.3901 -38.3861 -38.3861 -19.6382 -19.6382 -19.4425 -19.4425 -15.8116 -15.8116 -15.7913 -15.7913 -6.1684 -6.1684 -6.0382 -6.0382 -4.3300 -4.3300 -4.1294 -4.1294 -4.0369 -4.0369 -3.9981 -3.9981 -1.0757 -1.0757 -0.3671 -0.3671 2.2418 2.2418 2.2997 2.2997 2.3637 2.3637 2.4578 2.4578 2.8850 2.8850 2.9519 2.9519 5.1525 5.1525 5.7955 5.7955 6.3389 6.3389 6.5051 6.5051 6.8241 6.8241 7.1228 7.1228 7.2234 7.2234 8.1624 8.1624 8.2129 8.2129 8.5991 8.5991 8.7333 8.7333 8.7817 8.7817 8.8752 8.8752 9.2404 9.2404 10.0473 10.0473 10.3672 10.3672 10.6830 10.6830 11.3430 11.3430 k = 0.0000 0.0694 0.2280 ( 15810 PWs) bands (ev): -69.8694 -69.8694 -69.8639 -69.8639 -39.6509 -39.6509 -39.6333 -39.6333 -38.4940 -38.4940 -38.4640 -38.4640 -38.3901 -38.3901 -38.3861 -38.3861 -19.6366 -19.6366 -19.4425 -19.4425 -15.8130 -15.8130 -15.7927 -15.7927 -6.1699 -6.1699 -6.0375 -6.0375 -4.3313 -4.3313 -4.1365 -4.1365 -4.0323 -4.0323 -3.9970 -3.9970 -1.0687 -1.0687 -0.3647 -0.3647 2.2480 2.2480 2.3026 2.3026 2.3656 2.3656 2.4594 2.4594 2.8835 2.8835 2.9512 2.9512 5.1548 5.1548 5.7958 5.7958 6.3315 6.3315 6.4999 6.4999 6.8017 6.8017 7.1053 7.1053 7.2275 7.2275 8.1667 8.1667 8.2161 8.2161 8.5729 8.5729 8.7271 8.7271 8.7778 8.7778 8.8994 8.8994 9.2481 9.2481 9.9809 9.9809 10.3602 10.3602 10.7481 10.7481 11.3681 11.3681 k = 0.0000 0.0833 0.2280 ( 15830 PWs) bands (ev): -69.8696 -69.8696 -69.8649 -69.8649 -39.6508 -39.6508 -39.6334 -39.6334 -38.4939 -38.4939 -38.4642 -38.4642 -38.3901 -38.3901 -38.3861 -38.3861 -19.6346 -19.6346 -19.4425 -19.4425 -15.8145 -15.8145 -15.7943 -15.7943 -6.1717 -6.1717 -6.0368 -6.0368 -4.3329 -4.3329 -4.1438 -4.1438 -4.0284 -4.0284 -3.9956 -3.9956 -1.0601 -1.0601 -0.3619 -0.3619 2.2554 2.2554 2.3061 2.3061 2.3679 2.3679 2.4612 2.4612 2.8814 2.8814 2.9504 2.9504 5.1571 5.1571 5.7950 5.7950 6.3218 6.3218 6.4942 6.4942 6.7736 6.7736 7.0865 7.0865 7.2357 7.2357 8.1678 8.1678 8.2184 8.2184 8.5462 8.5462 8.7184 8.7184 8.7681 8.7681 8.9242 8.9242 9.2481 9.2481 9.9154 9.9154 10.3494 10.3494 10.8140 10.8140 11.3943 11.3943 k = 0.0000 0.0972 0.2280 ( 15842 PWs) bands (ev): -69.8698 -69.8698 -69.8654 -69.8654 -39.6507 -39.6507 -39.6335 -39.6335 -38.4937 -38.4937 -38.4644 -38.4644 -38.3901 -38.3901 -38.3862 -38.3862 -19.6323 -19.6323 -19.4425 -19.4425 -15.8164 -15.8164 -15.7962 -15.7962 -6.1737 -6.1737 -6.0361 -6.0361 -4.3347 -4.3347 -4.1510 -4.1510 -4.0253 -4.0253 -3.9938 -3.9938 -1.0501 -1.0501 -0.3585 -0.3585 2.2641 2.2641 2.3102 2.3102 2.3707 2.3707 2.4634 2.4634 2.8786 2.8786 2.9497 2.9497 5.1597 5.1597 5.7927 5.7927 6.3096 6.3096 6.4889 6.4889 6.7406 6.7406 7.0684 7.0684 7.2451 7.2451 8.1689 8.1689 8.2213 8.2213 8.5208 8.5208 8.7082 8.7082 8.7578 8.7578 8.9499 8.9499 9.2556 9.2556 9.8514 9.8514 10.3363 10.3363 10.8796 10.8796 11.4212 11.4212 k = 0.0000 0.1111 0.2280 ( 15844 PWs) bands (ev): -69.8704 -69.8704 -69.8650 -69.8650 -39.6506 -39.6506 -39.6337 -39.6337 -38.4935 -38.4935 -38.4646 -38.4646 -38.3901 -38.3901 -38.3862 -38.3862 -19.6297 -19.6297 -19.4425 -19.4425 -15.8185 -15.8185 -15.7984 -15.7984 -6.1758 -6.1758 -6.0355 -6.0355 -4.3368 -4.3368 -4.1578 -4.1578 -4.0232 -4.0232 -3.9918 -3.9918 -1.0385 -1.0385 -0.3546 -0.3546 2.2740 2.2740 2.3149 2.3149 2.3738 2.3738 2.4658 2.4658 2.8751 2.8751 2.9491 2.9491 5.1625 5.1625 5.7903 5.7903 6.2962 6.2962 6.4850 6.4850 6.7047 6.7047 7.0507 7.0507 7.2526 7.2526 8.1686 8.1686 8.2240 8.2240 8.5001 8.5001 8.6943 8.6943 8.7429 8.7429 8.9803 8.9803 9.2679 9.2679 9.7906 9.7906 10.3220 10.3220 10.9450 10.9450 11.4476 11.4476 k = 0.0000 0.1250 0.2280 ( 15840 PWs) bands (ev): -69.8699 -69.8699 -69.8653 -69.8653 -39.6505 -39.6505 -39.6338 -39.6338 -38.4932 -38.4932 -38.4649 -38.4649 -38.3900 -38.3900 -38.3862 -38.3862 -19.6268 -19.6268 -19.4426 -19.4426 -15.8208 -15.8208 -15.8008 -15.8008 -6.1778 -6.1778 -6.0350 -6.0350 -4.3389 -4.3389 -4.1641 -4.1641 -4.0221 -4.0221 -3.9899 -3.9899 -1.0253 -1.0253 -0.3503 -0.3503 2.2849 2.2849 2.3202 2.3202 2.3773 2.3773 2.4686 2.4686 2.8707 2.8707 2.9486 2.9486 5.1653 5.1653 5.7847 5.7847 6.2806 6.2806 6.4810 6.4810 6.6668 6.6668 7.0343 7.0343 7.2638 7.2638 8.1670 8.1670 8.2270 8.2270 8.4826 8.4826 8.6839 8.6839 8.7287 8.7287 9.0134 9.0134 9.2769 9.2769 9.7324 9.7324 10.3048 10.3048 11.0093 11.0093 11.4720 11.4720 k = 0.0000 0.1389 0.2280 ( 15840 PWs) bands (ev): -69.8698 -69.8698 -69.8653 -69.8653 -39.6503 -39.6503 -39.6340 -39.6340 -38.4930 -38.4930 -38.4651 -38.4651 -38.3900 -38.3900 -38.3863 -38.3863 -19.6236 -19.6236 -19.4427 -19.4427 -15.8233 -15.8233 -15.8035 -15.8035 -6.1799 -6.1799 -6.0347 -6.0347 -4.3412 -4.3412 -4.1699 -4.1699 -4.0217 -4.0217 -3.9881 -3.9881 -1.0107 -1.0107 -0.3456 -0.3456 2.2968 2.2968 2.3261 2.3261 2.3812 2.3812 2.4717 2.4717 2.8654 2.8654 2.9481 2.9481 5.1677 5.1677 5.7764 5.7764 6.2634 6.2634 6.4772 6.4772 6.6289 6.6289 7.0187 7.0187 7.2772 7.2772 8.1631 8.1631 8.2288 8.2288 8.4667 8.4667 8.6692 8.6692 8.7122 8.7122 9.0467 9.0467 9.2876 9.2876 9.6772 9.6772 10.2859 10.2859 11.0721 11.0721 11.4941 11.4941 k = 0.0000 0.1528 0.2280 ( 15856 PWs) bands (ev): -69.8705 -69.8705 -69.8656 -69.8656 -39.6501 -39.6501 -39.6342 -39.6342 -38.4927 -38.4927 -38.4655 -38.4655 -38.3900 -38.3900 -38.3863 -38.3863 -19.6200 -19.6200 -19.4428 -19.4428 -15.8261 -15.8261 -15.8063 -15.8063 -6.1819 -6.1819 -6.0346 -6.0346 -4.3435 -4.3435 -4.1751 -4.1751 -4.0222 -4.0222 -3.9868 -3.9868 -0.9946 -0.9946 -0.3405 -0.3405 2.3096 2.3096 2.3325 2.3325 2.3855 2.3855 2.4750 2.4750 2.8593 2.8593 2.9477 2.9477 5.1695 5.1695 5.7631 5.7631 6.2450 6.2450 6.4721 6.4721 6.5938 6.5938 7.0037 7.0037 7.2884 7.2884 8.1550 8.1550 8.2274 8.2274 8.4540 8.4540 8.6511 8.6511 8.6931 8.6931 9.0798 9.0798 9.2995 9.2995 9.6255 9.6255 10.2643 10.2643 11.1335 11.1335 11.5128 11.5128 k = 0.0000 0.1667 0.2280 ( 15860 PWs) bands (ev): -69.8707 -69.8707 -69.8656 -69.8656 -39.6499 -39.6499 -39.6344 -39.6344 -38.4924 -38.4924 -38.4658 -38.4658 -38.3899 -38.3899 -38.3864 -38.3864 -19.6162 -19.6162 -19.4430 -19.4430 -15.8289 -15.8289 -15.8094 -15.8094 -6.1838 -6.1838 -6.0347 -6.0347 -4.3458 -4.3458 -4.1796 -4.1796 -4.0232 -4.0232 -3.9861 -3.9861 -0.9770 -0.9770 -0.3350 -0.3350 2.3231 2.3231 2.3395 2.3395 2.3903 2.3903 2.4786 2.4786 2.8524 2.8524 2.9470 2.9470 5.1704 5.1704 5.7456 5.7456 6.2255 6.2255 6.4657 6.4657 6.5648 6.5648 6.9892 6.9892 7.3023 7.3023 8.1467 8.1467 8.2254 8.2254 8.4454 8.4454 8.6336 8.6336 8.6740 8.6740 9.1157 9.1157 9.3116 9.3116 9.5767 9.5767 10.2421 10.2421 11.1928 11.1928 11.5256 11.5256 k = 0.0000 0.1806 0.2280 ( 15874 PWs) bands (ev): -69.8713 -69.8713 -69.8659 -69.8659 -39.6498 -39.6498 -39.6346 -39.6346 -38.4921 -38.4921 -38.4662 -38.4662 -38.3899 -38.3899 -38.3865 -38.3865 -19.6122 -19.6122 -19.4433 -19.4433 -15.8319 -15.8319 -15.8126 -15.8126 -6.1854 -6.1854 -6.0351 -6.0351 -4.3480 -4.3480 -4.1834 -4.1834 -4.0248 -4.0248 -3.9862 -3.9862 -0.9580 -0.9580 -0.3294 -0.3294 2.3370 2.3370 2.3472 2.3472 2.3955 2.3955 2.4824 2.4824 2.8448 2.8448 2.9462 2.9462 5.1703 5.1703 5.7225 5.7225 6.2052 6.2052 6.4563 6.4563 6.5442 6.5442 6.9757 6.9757 7.3187 7.3187 8.1348 8.1348 8.2212 8.2212 8.4374 8.4374 8.6120 8.6120 8.6526 8.6526 9.1512 9.1512 9.3248 9.3248 9.5305 9.5305 10.2189 10.2189 11.2498 11.2498 11.5271 11.5271 k = 0.0000 0.1944 0.2280 ( 15878 PWs) bands (ev): -69.8717 -69.8717 -69.8657 -69.8657 -39.6495 -39.6495 -39.6348 -39.6348 -38.4917 -38.4917 -38.4666 -38.4666 -38.3898 -38.3898 -38.3865 -38.3865 -19.6079 -19.6079 -19.4437 -19.4437 -15.8351 -15.8351 -15.8160 -15.8160 -6.1869 -6.1869 -6.0357 -6.0357 -4.3500 -4.3500 -4.1865 -4.1865 -4.0270 -4.0270 -3.9870 -3.9870 -0.9377 -0.9377 -0.3234 -0.3234 2.3503 2.3503 2.3562 2.3562 2.4014 2.4014 2.4864 2.4864 2.8365 2.8365 2.9449 2.9449 5.1692 5.1692 5.6944 5.6944 6.1866 6.1866 6.4445 6.4445 6.5333 6.5333 6.9620 6.9620 7.3340 7.3340 8.1221 8.1221 8.2189 8.2189 8.4303 8.4303 8.5919 8.5919 8.6308 8.6308 9.1880 9.1880 9.3364 9.3364 9.4896 9.4896 10.1951 10.1951 11.3053 11.3053 11.5119 11.5119 k = 0.0000 0.2083 0.2280 ( 15886 PWs) bands (ev): -69.8719 -69.8719 -69.8659 -69.8659 -39.6493 -39.6493 -39.6351 -39.6351 -38.4913 -38.4913 -38.4670 -38.4670 -38.3898 -38.3898 -38.3866 -38.3866 -19.6033 -19.6033 -19.4441 -19.4441 -15.8383 -15.8383 -15.8195 -15.8195 -6.1881 -6.1881 -6.0368 -6.0368 -4.3517 -4.3517 -4.1889 -4.1889 -4.0298 -4.0298 -3.9887 -3.9887 -0.9160 -0.9160 -0.3174 -0.3174 2.3608 2.3608 2.3684 2.3684 2.4081 2.4081 2.4906 2.4906 2.8275 2.8275 2.9432 2.9432 5.1665 5.1665 5.6603 5.6603 6.1682 6.1682 6.4318 6.4318 6.5287 6.5287 6.9484 6.9484 7.3517 7.3517 8.1090 8.1090 8.2164 8.2164 8.4238 8.4238 8.5709 8.5709 8.6082 8.6082 9.2243 9.2243 9.3490 9.3490 9.4512 9.4512 10.1696 10.1696 11.3578 11.3578 11.4745 11.4745 k = 0.0000 0.2222 0.2280 ( 15902 PWs) bands (ev): -69.8726 -69.8726 -69.8662 -69.8662 -39.6491 -39.6491 -39.6353 -39.6353 -38.4909 -38.4909 -38.4675 -38.4675 -38.3897 -38.3897 -38.3867 -38.3867 -19.5986 -19.5986 -19.4447 -19.4447 -15.8415 -15.8415 -15.8231 -15.8231 -6.1889 -6.1889 -6.0381 -6.0381 -4.3531 -4.3531 -4.1907 -4.1907 -4.0331 -4.0331 -3.9913 -3.9913 -0.8931 -0.8931 -0.3113 -0.3113 2.3697 2.3697 2.3819 2.3819 2.4160 2.4160 2.4949 2.4949 2.8181 2.8181 2.9409 2.9409 5.1624 5.1624 5.6213 5.6213 6.1518 6.1518 6.4214 6.4214 6.5290 6.5290 6.9347 6.9347 7.3690 7.3690 8.0943 8.0943 8.2142 8.2142 8.4161 8.4161 8.5458 8.5458 8.5823 8.5823 9.2595 9.2595 9.3611 9.3611 9.4168 9.4168 10.1438 10.1438 11.4069 11.4069 11.4188 11.4188 k = 0.0000 0.2361 0.2280 ( 15890 PWs) bands (ev): -69.8723 -69.8723 -69.8658 -69.8658 -39.6488 -39.6488 -39.6356 -39.6356 -38.4905 -38.4905 -38.4679 -38.4679 -38.3897 -38.3897 -38.3867 -38.3867 -19.5937 -19.5937 -19.4453 -19.4453 -15.8448 -15.8448 -15.8268 -15.8268 -6.1895 -6.1895 -6.0398 -6.0398 -4.3540 -4.3540 -4.1918 -4.1918 -4.0370 -4.0370 -3.9946 -3.9946 -0.8690 -0.8690 -0.3053 -0.3053 2.3785 2.3785 2.3945 2.3945 2.4259 2.4259 2.4992 2.4992 2.8082 2.8082 2.9378 2.9378 5.1565 5.1565 5.5783 5.5783 6.1384 6.1384 6.4145 6.4145 6.5325 6.5325 6.9218 6.9218 7.3882 7.3882 8.0833 8.0833 8.2133 8.2133 8.4102 8.4102 8.5247 8.5247 8.5596 8.5596 9.2945 9.2945 9.3755 9.3755 9.3892 9.3892 10.1177 10.1177 11.3506 11.3506 11.4551 11.4551 k = 0.0000 0.2500 0.2280 ( 15888 PWs) bands (ev): -69.8721 -69.8721 -69.8659 -69.8659 -39.6485 -39.6485 -39.6359 -39.6359 -38.4900 -38.4900 -38.4684 -38.4684 -38.3896 -38.3896 -38.3868 -38.3868 -19.5886 -19.5886 -19.4461 -19.4461 -15.8481 -15.8481 -15.8306 -15.8306 -6.1897 -6.1897 -6.0419 -6.0419 -4.3544 -4.3544 -4.1924 -4.1924 -4.0415 -4.0415 -3.9987 -3.9987 -0.8438 -0.8438 -0.2995 -0.2995 2.3873 2.3873 2.4053 2.4053 2.4382 2.4382 2.5037 2.5037 2.7979 2.7979 2.9339 2.9339 5.1485 5.1485 5.5320 5.5320 6.1281 6.1281 6.4110 6.4110 6.5378 6.5378 6.9084 6.9084 7.4097 7.4097 8.0708 8.0708 8.2115 8.2115 8.4028 8.4028 8.5019 8.5019 8.5352 8.5352 9.3207 9.3207 9.3675 9.3675 9.3896 9.3896 10.0909 10.0909 11.2798 11.2798 11.4989 11.4989 k = 0.0000 0.2639 0.2280 ( 15886 PWs) bands (ev): -69.8721 -69.8721 -69.8657 -69.8657 -39.6483 -39.6483 -39.6362 -39.6362 -38.4896 -38.4896 -38.4689 -38.4689 -38.3895 -38.3895 -38.3868 -38.3868 -19.5833 -19.5833 -19.4471 -19.4471 -15.8514 -15.8514 -15.8344 -15.8344 -6.1895 -6.1895 -6.0444 -6.0444 -4.3543 -4.3543 -4.1923 -4.1923 -4.0467 -4.0467 -4.0035 -4.0035 -0.8177 -0.8177 -0.2939 -0.2939 2.3963 2.3963 2.4145 2.4145 2.4525 2.4525 2.5081 2.5081 2.7872 2.7872 2.9291 2.9291 5.1385 5.1385 5.4838 5.4838 6.1210 6.1210 6.4104 6.4104 6.5444 6.5444 6.8952 6.8952 7.4310 7.4310 8.0594 8.0594 8.2079 8.2079 8.3947 8.3947 8.4785 8.4785 8.5105 8.5105 9.3194 9.3194 9.3766 9.3766 9.4034 9.4034 10.0640 10.0640 11.2106 11.2106 11.5390 11.5390 k = 0.0000 0.2778 0.2280 ( 15890 PWs) bands (ev): -69.8723 -69.8723 -69.8657 -69.8657 -39.6480 -39.6480 -39.6365 -39.6365 -38.4891 -38.4891 -38.4694 -38.4694 -38.3895 -38.3895 -38.3869 -38.3869 -19.5780 -19.5780 -19.4481 -19.4481 -15.8547 -15.8547 -15.8382 -15.8382 -6.1889 -6.1889 -6.0472 -6.0472 -4.3535 -4.3535 -4.1917 -4.1917 -4.0525 -4.0525 -4.0089 -4.0089 -0.7906 -0.7906 -0.2887 -0.2887 2.4052 2.4052 2.4227 2.4227 2.4681 2.4681 2.5125 2.5125 2.7763 2.7763 2.9234 2.9234 5.1267 5.1267 5.4346 5.4346 6.1178 6.1178 6.4121 6.4121 6.5518 6.5518 6.8816 6.8816 7.4549 7.4549 8.0479 8.0479 8.2043 8.2043 8.3845 8.3845 8.4524 8.4524 8.4833 8.4833 9.3028 9.3028 9.4003 9.4003 9.4162 9.4162 10.0359 10.0359 11.1467 11.1467 11.5753 11.5753 k = 0.0000 0.2917 0.2280 ( 15890 PWs) bands (ev): -69.8722 -69.8722 -69.8658 -69.8658 -39.6477 -39.6477 -39.6368 -39.6368 -38.4886 -38.4886 -38.4700 -38.4700 -38.3894 -38.3894 -38.3870 -38.3870 -19.5725 -19.5725 -19.4494 -19.4494 -15.8578 -15.8578 -15.8420 -15.8420 -6.1879 -6.1879 -6.0504 -6.0504 -4.3520 -4.3520 -4.1907 -4.1907 -4.0591 -4.0591 -4.0148 -4.0148 -0.7629 -0.7629 -0.2840 -0.2840 2.4141 2.4141 2.4303 2.4303 2.4844 2.4844 2.5169 2.5169 2.7653 2.7653 2.9167 2.9167 5.1132 5.1132 5.3853 5.3853 6.1183 6.1183 6.4154 6.4154 6.5600 6.5600 6.8681 6.8681 7.4788 7.4788 8.0381 8.0381 8.2001 8.2001 8.3749 8.3749 8.4268 8.4268 8.4579 8.4579 9.2859 9.2859 9.4196 9.4196 9.4323 9.4323 10.0083 10.0083 11.0904 11.0904 11.6074 11.6074 k = 0.0000 0.3056 0.2280 ( 15896 PWs) bands (ev): -69.8723 -69.8723 -69.8661 -69.8661 -39.6474 -39.6474 -39.6371 -39.6371 -38.4880 -38.4880 -38.4705 -38.4705 -38.3893 -38.3893 -38.3871 -38.3871 -19.5669 -19.5669 -19.4508 -19.4508 -15.8608 -15.8608 -15.8457 -15.8457 -6.1864 -6.1864 -6.0539 -6.0539 -4.3498 -4.3498 -4.1892 -4.1892 -4.0663 -4.0663 -4.0210 -4.0210 -0.7345 -0.7345 -0.2801 -0.2801 2.4229 2.4229 2.4378 2.4378 2.5009 2.5009 2.5212 2.5212 2.7541 2.7541 2.9090 2.9090 5.0983 5.0983 5.3367 5.3367 6.1221 6.1221 6.4195 6.4195 6.5685 6.5685 6.8543 6.8543 7.5040 7.5040 8.0301 8.0301 8.1941 8.1941 8.3628 8.3628 8.3999 8.3999 8.4325 8.4325 9.2699 9.2699 9.4328 9.4328 9.4515 9.4515 9.9806 9.9806 11.0433 11.0433 11.6347 11.6347 k = 0.0000 0.3194 0.2280 ( 15890 PWs) bands (ev): -69.8718 -69.8718 -69.8661 -69.8661 -39.6470 -39.6470 -39.6374 -39.6374 -38.4875 -38.4875 -38.4711 -38.4711 -38.3893 -38.3893 -38.3871 -38.3871 -19.5613 -19.5613 -19.4524 -19.4524 -15.8637 -15.8637 -15.8494 -15.8494 -6.1846 -6.1846 -6.0578 -6.0578 -4.3469 -4.3469 -4.1874 -4.1874 -4.0743 -4.0743 -4.0275 -4.0275 -0.7057 -0.7057 -0.2769 -0.2769 2.4314 2.4314 2.4451 2.4451 2.5173 2.5173 2.5253 2.5253 2.7430 2.7430 2.9003 2.9003 5.0824 5.0824 5.2898 5.2898 6.1300 6.1300 6.4247 6.4247 6.5776 6.5776 6.8410 6.8410 7.5300 7.5300 8.0251 8.0251 8.1888 8.1888 8.3500 8.3500 8.3731 8.3731 8.4094 8.4094 9.2578 9.2578 9.4443 9.4443 9.4688 9.4688 9.9533 9.9533 11.0066 11.0066 11.6579 11.6579 k = 0.0000 0.3333 0.2280 ( 15886 PWs) bands (ev): -69.8713 -69.8713 -69.8664 -69.8664 -39.6467 -39.6467 -39.6378 -39.6378 -38.4869 -38.4869 -38.4717 -38.4717 -38.3892 -38.3892 -38.3872 -38.3872 -19.5557 -19.5557 -19.4542 -19.4542 -15.8665 -15.8665 -15.8530 -15.8530 -6.1823 -6.1823 -6.0621 -6.0621 -4.3431 -4.3431 -4.1853 -4.1853 -4.0829 -4.0829 -4.0341 -4.0341 -0.6766 -0.6766 -0.2747 -0.2747 2.4397 2.4397 2.4525 2.4525 2.5293 2.5293 2.5335 2.5335 2.7319 2.7319 2.8907 2.8907 5.0661 5.0661 5.2449 5.2449 6.1414 6.1414 6.4295 6.4295 6.5861 6.5861 6.8276 6.8276 7.5568 7.5568 8.0205 8.0205 8.1842 8.1842 8.3345 8.3345 8.3463 8.3463 8.3878 8.3878 9.2488 9.2488 9.4539 9.4539 9.4816 9.4816 9.9252 9.9252 10.9811 10.9811 11.6769 11.6769 k = 0.0000 0.3472 0.2280 ( 15894 PWs) bands (ev): -69.8719 -69.8719 -69.8663 -69.8663 -39.6464 -39.6464 -39.6381 -39.6381 -38.4863 -38.4863 -38.4723 -38.4723 -38.3891 -38.3891 -38.3873 -38.3873 -19.5500 -19.5500 -19.4562 -19.4562 -15.8691 -15.8691 -15.8564 -15.8564 -6.1797 -6.1797 -6.0666 -6.0666 -4.3386 -4.3386 -4.1830 -4.1830 -4.0920 -4.0920 -4.0409 -4.0409 -0.6473 -0.6473 -0.2736 -0.2736 2.4477 2.4477 2.4599 2.4599 2.5332 2.5332 2.5493 2.5493 2.7211 2.7211 2.8801 2.8801 5.0493 5.0493 5.2026 5.2026 6.1550 6.1550 6.4346 6.4346 6.5952 6.5952 6.8142 6.8142 7.5840 7.5840 8.0138 8.0138 8.1754 8.1754 8.3115 8.3115 8.3259 8.3259 8.3642 8.3642 9.2407 9.2407 9.4613 9.4613 9.4910 9.4910 9.8987 9.8987 10.9673 10.9673 11.6910 11.6910 k = 0.0000 0.3611 0.2280 ( 15888 PWs) bands (ev): -69.8716 -69.8716 -69.8662 -69.8662 -39.6460 -39.6460 -39.6385 -39.6385 -38.4858 -38.4858 -38.4729 -38.4729 -38.3890 -38.3890 -38.3874 -38.3874 -19.5444 -19.5444 -19.4584 -19.4584 -15.8714 -15.8714 -15.8597 -15.8597 -6.1766 -6.1766 -6.0714 -6.0714 -4.3332 -4.3332 -4.1807 -4.1807 -4.1015 -4.1015 -4.0477 -4.0477 -0.6181 -0.6181 -0.2738 -0.2738 2.4554 2.4554 2.4672 2.4672 2.5369 2.5369 2.5644 2.5644 2.7106 2.7106 2.8688 2.8688 5.0329 5.0329 5.1632 5.1632 6.1722 6.1722 6.4394 6.4394 6.6041 6.6041 6.8011 6.8011 7.6114 7.6114 8.0103 8.0103 8.1689 8.1689 8.2832 8.2832 8.3095 8.3095 8.3459 8.3459 9.2379 9.2379 9.4643 9.4643 9.5000 9.5000 9.8721 9.8721 10.9650 10.9650 11.7019 11.7019 k = 0.0000 0.3750 0.2280 ( 15904 PWs) bands (ev): -69.8719 -69.8719 -69.8669 -69.8669 -39.6457 -39.6457 -39.6388 -39.6388 -38.4852 -38.4852 -38.4735 -38.4735 -38.3890 -38.3890 -38.3875 -38.3875 -19.5387 -19.5387 -19.4608 -19.4608 -15.8736 -15.8736 -15.8629 -15.8629 -6.1732 -6.1732 -6.0765 -6.0765 -4.3271 -4.3271 -4.1788 -4.1788 -4.1108 -4.1108 -4.0545 -4.0545 -0.5891 -0.5891 -0.2753 -0.2753 2.4627 2.4627 2.4743 2.4743 2.5405 2.5405 2.5786 2.5786 2.7009 2.7009 2.8567 2.8567 5.0169 5.0169 5.1269 5.1269 6.1908 6.1908 6.4424 6.4424 6.6114 6.6114 6.7880 6.7880 7.6388 7.6388 8.0070 8.0070 8.1585 8.1585 8.2535 8.2535 8.2926 8.2926 8.3250 8.3250 9.2348 9.2348 9.4608 9.4608 9.5096 9.5096 9.8441 9.8441 10.9736 10.9736 11.7089 11.7089 k = 0.0000 0.3889 0.2280 ( 15900 PWs) bands (ev): -69.8706 -69.8706 -69.8679 -69.8679 -39.6453 -39.6453 -39.6392 -39.6392 -38.4846 -38.4846 -38.4741 -38.4741 -38.3889 -38.3889 -38.3875 -38.3875 -19.5331 -19.5331 -19.4635 -19.4635 -15.8754 -15.8754 -15.8658 -15.8658 -6.1693 -6.1693 -6.0818 -6.0818 -4.3201 -4.3201 -4.1776 -4.1776 -4.1195 -4.1195 -4.0613 -4.0613 -0.5605 -0.5605 -0.2784 -0.2784 2.4697 2.4697 2.4811 2.4811 2.5441 2.5441 2.5914 2.5914 2.6923 2.6923 2.8440 2.8440 5.0021 5.0021 5.0939 5.0939 6.2119 6.2119 6.4445 6.4445 6.6192 6.6192 6.7752 6.7752 7.6718 7.6718 8.0085 8.0085 8.1487 8.1487 8.2232 8.2232 8.2760 8.2760 8.3071 8.3071 9.2363 9.2363 9.4530 9.4530 9.5201 9.5201 9.8182 9.8182 10.9927 10.9927 11.7138 11.7138 k = 0.0000 0.4028 0.2280 ( 15894 PWs) bands (ev): -69.8701 -69.8701 -69.8680 -69.8680 -39.6450 -39.6450 -39.6396 -39.6396 -38.4840 -38.4840 -38.4747 -38.4747 -38.3888 -38.3888 -38.3876 -38.3876 -19.5276 -19.5276 -19.4663 -19.4663 -15.8771 -15.8771 -15.8685 -15.8685 -6.1652 -6.1652 -6.0873 -6.0873 -4.3124 -4.3124 -4.1782 -4.1782 -4.1266 -4.1266 -4.0681 -4.0681 -0.5324 -0.5324 -0.2831 -0.2831 2.4763 2.4763 2.4875 2.4875 2.5478 2.5478 2.6022 2.6022 2.6856 2.6856 2.8308 2.8308 4.9886 4.9886 5.0643 5.0643 6.2342 6.2342 6.4454 6.4454 6.6272 6.6272 6.7629 6.7629 7.7034 7.7034 8.0087 8.0087 8.1370 8.1370 8.1960 8.1960 8.2619 8.2619 8.2906 8.2906 9.2399 9.2399 9.4407 9.4407 9.5330 9.5330 9.7937 9.7937 11.0209 11.0209 11.7167 11.7167 k = 0.0000 0.4167 0.2280 ( 15902 PWs) bands (ev): -69.8703 -69.8703 -69.8683 -69.8683 -39.6446 -39.6446 -39.6399 -39.6399 -38.4833 -38.4833 -38.4754 -38.4754 -38.3888 -38.3888 -38.3877 -38.3877 -19.5222 -19.5222 -19.4694 -19.4694 -15.8784 -15.8784 -15.8710 -15.8710 -6.1607 -6.1607 -6.0930 -6.0930 -4.3040 -4.3040 -4.1815 -4.1815 -4.1310 -4.1310 -4.0749 -4.0749 -0.5051 -0.5051 -0.2895 -0.2895 2.4824 2.4824 2.4932 2.4932 2.5516 2.5516 2.6097 2.6097 2.6822 2.6822 2.8173 2.8173 4.9768 4.9768 5.0382 5.0382 6.2571 6.2571 6.4443 6.4443 6.6348 6.6348 6.7504 6.7504 7.7340 7.7340 8.0086 8.0086 8.1206 8.1206 8.1702 8.1702 8.2474 8.2474 8.2736 8.2736 9.2449 9.2449 9.4250 9.4250 9.5461 9.5461 9.7699 9.7699 11.0571 11.0571 11.7177 11.7177 k = 0.0000 0.4306 0.2280 ( 15904 PWs) bands (ev): -69.8702 -69.8702 -69.8685 -69.8685 -39.6442 -39.6442 -39.6403 -39.6403 -38.4827 -38.4827 -38.4761 -38.4761 -38.3887 -38.3887 -38.3878 -38.3878 -19.5169 -19.5169 -19.4727 -19.4727 -15.8795 -15.8795 -15.8732 -15.8732 -6.1559 -6.1559 -6.0988 -6.0988 -4.2949 -4.2949 -4.1878 -4.1878 -4.1323 -4.1323 -4.0816 -4.0816 -0.4788 -0.4788 -0.2978 -0.2978 2.4881 2.4881 2.4981 2.4981 2.5558 2.5558 2.6127 2.6127 2.6832 2.6832 2.8035 2.8035 4.9668 4.9668 5.0157 5.0157 6.2804 6.2804 6.4413 6.4413 6.6427 6.6427 6.7385 6.7385 7.7666 7.7666 8.0095 8.0095 8.1007 8.1007 8.1485 8.1485 8.2348 8.2348 8.2583 8.2583 9.2521 9.2521 9.4082 9.4082 9.5603 9.5603 9.7471 9.7471 11.1006 11.1006 11.7143 11.7143 k = 0.0000 0.4444 0.2280 ( 15922 PWs) bands (ev): -69.8703 -69.8703 -69.8695 -69.8695 -39.6438 -39.6438 -39.6407 -39.6407 -38.4821 -38.4821 -38.4767 -38.4767 -38.3886 -38.3886 -38.3879 -38.3879 -19.5117 -19.5117 -19.4762 -19.4762 -15.8803 -15.8803 -15.8752 -15.8752 -6.1508 -6.1508 -6.1047 -6.1047 -4.2852 -4.2852 -4.1967 -4.1967 -4.1310 -4.1310 -4.0882 -4.0882 -0.4536 -0.4536 -0.3078 -0.3078 2.4932 2.4932 2.5019 2.5019 2.5605 2.5605 2.6111 2.6111 2.6889 2.6889 2.7895 2.7895 4.9589 4.9589 4.9966 4.9966 6.3033 6.3033 6.4352 6.4352 6.6492 6.6492 6.7259 6.7259 7.7962 7.7962 8.0079 8.0079 8.0781 8.0781 8.1276 8.1276 8.2274 8.2274 8.2464 8.2464 9.2600 9.2600 9.3893 9.3893 9.5736 9.5736 9.7228 9.7228 11.1500 11.1500 11.6646 11.6646 k = 0.0000 0.4583 0.2280 ( 15920 PWs) bands (ev): -69.8700 -69.8700 -69.8697 -69.8697 -39.6435 -39.6435 -39.6411 -39.6411 -38.4814 -38.4814 -38.4774 -38.4774 -38.3885 -38.3885 -38.3880 -38.3880 -19.5066 -19.5066 -19.4799 -19.4799 -15.8807 -15.8807 -15.8769 -15.8769 -6.1455 -6.1455 -6.1106 -6.1106 -4.2749 -4.2749 -4.2070 -4.2070 -4.1278 -4.1278 -4.0947 -4.0947 -0.4297 -0.4297 -0.3198 -0.3198 2.4976 2.4976 2.5047 2.5047 2.5658 2.5658 2.6064 2.6064 2.6980 2.6980 2.7755 2.7755 4.9536 4.9536 4.9809 4.9809 6.3260 6.3260 6.4267 6.4267 6.6573 6.6573 6.7145 6.7145 7.8301 7.8301 8.0001 8.0001 8.0631 8.0631 8.1121 8.1121 8.2221 8.2221 8.2365 8.2365 9.2714 9.2714 9.3697 9.3697 9.5891 9.5891 9.7016 9.7016 11.2045 11.2045 11.5962 11.5962 k = 0.0000 0.4722 0.2280 ( 15906 PWs) bands (ev): -69.8700 -69.8700 -69.8688 -69.8688 -39.6431 -39.6431 -39.6415 -39.6415 -38.4808 -38.4808 -38.4780 -38.4780 -38.3884 -38.3884 -38.3880 -38.3880 -19.5017 -19.5017 -19.4839 -19.4839 -15.8809 -15.8809 -15.8783 -15.8783 -6.1400 -6.1400 -6.1166 -6.1166 -4.2641 -4.2641 -4.2182 -4.2182 -4.1235 -4.1235 -4.1010 -4.1010 -0.4071 -0.4071 -0.3336 -0.3336 2.5012 2.5012 2.5062 2.5062 2.5718 2.5718 2.6000 2.6000 2.7091 2.7091 2.7616 2.7616 4.9509 4.9509 4.9687 4.9687 6.3481 6.3481 6.4160 6.4160 6.6654 6.6654 6.7036 6.7036 7.8625 7.8625 7.9808 7.9808 8.0634 8.0634 8.0984 8.0984 8.2217 8.2217 8.2311 8.2311 9.2851 9.2851 9.3523 9.3523 9.6055 9.6055 9.6802 9.6802 11.2640 11.2640 11.5267 11.5267 k = 0.0000 0.4861 0.2280 ( 15906 PWs) bands (ev): -69.8699 -69.8699 -69.8690 -69.8690 -39.6427 -39.6427 -39.6419 -39.6419 -38.4801 -38.4801 -38.4787 -38.4787 -38.3883 -38.3883 -38.3881 -38.3881 -19.4970 -19.4970 -19.4881 -19.4881 -15.8807 -15.8807 -15.8794 -15.8794 -6.1343 -6.1343 -6.1226 -6.1226 -4.2529 -4.2529 -4.2298 -4.2298 -4.1185 -4.1185 -4.1071 -4.1071 -0.3861 -0.3861 -0.3493 -0.3493 2.5040 2.5040 2.5066 2.5066 2.5784 2.5784 2.5928 2.5928 2.7214 2.7214 2.7479 2.7479 4.9509 4.9509 4.9596 4.9596 6.3683 6.3683 6.4025 6.4025 6.6745 6.6745 6.6933 6.6933 7.8945 7.8945 7.9535 7.9535 8.0677 8.0677 8.0868 8.0868 8.2194 8.2194 8.2245 8.2245 9.3004 9.3004 9.3340 9.3340 9.6230 9.6230 9.6609 9.6609 11.3261 11.3261 11.4582 11.4582 k = 0.0000 0.5000 0.2280 ( 15924 PWs) bands (ev): -69.8700 -69.8700 -69.8700 -69.8700 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2414 -4.2414 -4.2414 -4.2414 -4.1130 -4.1130 -4.1130 -4.1130 -0.3668 -0.3668 -0.3668 -0.3668 2.5058 2.5058 2.5058 2.5058 2.5855 2.5855 2.5855 2.5855 2.7344 2.7344 2.7344 2.7344 4.9537 4.9537 4.9537 4.9537 6.3862 6.3862 6.3862 6.3862 6.6828 6.6828 6.6828 6.6828 7.9226 7.9226 7.9226 7.9226 8.0753 8.0753 8.0753 8.0753 8.2188 8.2188 8.2188 8.2188 9.3158 9.3158 9.3158 9.3158 9.6402 9.6402 9.6402 9.6402 11.3911 11.3911 11.3911 11.3911 k = 0.0000 0.5000 0.2280 ( 15924 PWs) bands (ev): -69.8700 -69.8700 -69.8700 -69.8700 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2414 -4.2414 -4.2414 -4.2414 -4.1130 -4.1130 -4.1130 -4.1130 -0.3668 -0.3668 -0.3668 -0.3668 2.5058 2.5058 2.5058 2.5058 2.5855 2.5855 2.5855 2.5855 2.7344 2.7344 2.7344 2.7344 4.9537 4.9537 4.9537 4.9537 6.3862 6.3862 6.3862 6.3862 6.6828 6.6828 6.6828 6.6828 7.9226 7.9226 7.9226 7.9226 8.0753 8.0753 8.0753 8.0753 8.2188 8.2188 8.2188 8.2188 9.3158 9.3158 9.3158 9.3158 9.6402 9.6402 9.6402 9.6402 11.3911 11.3911 11.3911 11.3911 k = 0.0139 0.5000 0.2280 ( 15912 PWs) bands (ev): -69.8696 -69.8696 -69.8696 -69.8696 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4923 -19.4923 -19.4923 -19.4923 -15.8805 -15.8805 -15.8803 -15.8803 -6.1332 -6.1332 -6.1238 -6.1238 -4.2426 -4.2426 -4.2407 -4.2407 -4.1205 -4.1205 -4.1050 -4.1050 -0.3666 -0.3666 -0.3664 -0.3664 2.5035 2.5035 2.5085 2.5085 2.5765 2.5765 2.5919 2.5919 2.7273 2.7273 2.7445 2.7445 4.9540 4.9540 4.9542 4.9542 6.3803 6.3803 6.3917 6.3917 6.6795 6.6795 6.6857 6.6857 7.9196 7.9196 7.9246 7.9246 8.0720 8.0720 8.0819 8.0819 8.2182 8.2182 8.2205 8.2205 9.3043 9.3043 9.3145 9.3145 9.6360 9.6360 9.6532 9.6532 11.3924 11.3924 11.3963 11.3963 k = 0.0278 0.5000 0.2280 ( 15904 PWs) bands (ev): -69.8694 -69.8694 -69.8694 -69.8694 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4920 -19.4920 -19.4920 -19.4920 -15.8810 -15.8810 -15.8806 -15.8806 -6.1380 -6.1380 -6.1193 -6.1193 -4.2441 -4.2441 -4.2408 -4.2408 -4.1274 -4.1274 -4.0969 -4.0969 -0.3656 -0.3656 -0.3653 -0.3653 2.5013 2.5013 2.5116 2.5116 2.5663 2.5663 2.5947 2.5947 2.7241 2.7241 2.7565 2.7565 4.9548 4.9548 4.9554 4.9554 6.3738 6.3738 6.3969 6.3969 6.6734 6.6734 6.6861 6.6861 7.9120 7.9120 7.9214 7.9214 8.0710 8.0710 8.0899 8.0899 8.2182 8.2182 8.2230 8.2230 9.2822 9.2822 9.2999 9.2999 9.6371 9.6371 9.6685 9.6685 11.4001 11.4001 11.4077 11.4077 k = 0.0417 0.5000 0.2280 ( 15908 PWs) bands (ev): -69.8695 -69.8695 -69.8695 -69.8695 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4916 -19.4916 -19.4916 -19.4916 -15.8819 -15.8819 -15.8813 -15.8813 -6.1428 -6.1428 -6.1149 -6.1149 -4.2459 -4.2459 -4.2418 -4.2418 -4.1333 -4.1333 -4.0887 -4.0887 -0.3640 -0.3640 -0.3636 -0.3636 2.4988 2.4988 2.5154 2.5154 2.5562 2.5562 2.5930 2.5930 2.7255 2.7255 2.7697 2.7697 4.9563 4.9563 4.9572 4.9572 6.3667 6.3667 6.4013 6.4013 6.6645 6.6645 6.6834 6.6834 7.9005 7.9005 7.9120 7.9120 8.0711 8.0711 8.0967 8.0967 8.2184 8.2184 8.2253 8.2253 9.2511 9.2511 9.2731 9.2731 9.6422 9.6422 9.6841 9.6841 11.4136 11.4136 11.4244 11.4244 k = 0.0556 0.5000 0.2280 ( 15904 PWs) bands (ev): -69.8694 -69.8694 -69.8694 -69.8694 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4909 -19.4909 -19.4909 -19.4909 -15.8831 -15.8831 -15.8823 -15.8823 -6.1476 -6.1476 -6.1107 -6.1107 -4.2477 -4.2477 -4.2439 -4.2439 -4.1380 -4.1380 -4.0807 -4.0807 -0.3617 -0.3617 -0.3611 -0.3611 2.4950 2.4950 2.5199 2.5199 2.5475 2.5475 2.5872 2.5872 2.7311 2.7311 2.7835 2.7835 4.9583 4.9583 4.9596 4.9596 6.3590 6.3590 6.4058 6.4058 6.6538 6.6538 6.6797 6.6797 7.8868 7.8868 7.8997 7.8997 8.0723 8.0723 8.1029 8.1029 8.2207 8.2207 8.2291 8.2291 9.2157 9.2157 9.2388 9.2388 9.6500 9.6500 9.6983 9.6983 11.4319 11.4319 11.4452 11.4452 k = 0.0694 0.5000 0.2280 ( 15908 PWs) bands (ev): -69.8695 -69.8695 -69.8695 -69.8695 -39.6423 -39.6423 -39.6423 -39.6423 -38.4795 -38.4795 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4900 -19.4900 -19.4900 -19.4900 -15.8845 -15.8845 -15.8835 -15.8835 -6.1523 -6.1523 -6.1067 -6.1067 -4.2495 -4.2495 -4.2472 -4.2472 -4.1415 -4.1415 -4.0730 -4.0730 -0.3588 -0.3588 -0.3581 -0.3581 2.4892 2.4892 2.5251 2.5251 2.5415 2.5415 2.5783 2.5783 2.7398 2.7398 2.7976 2.7976 4.9607 4.9607 4.9625 4.9625 6.3499 6.3499 6.4097 6.4097 6.6404 6.6404 6.6742 6.6742 7.8711 7.8711 7.8852 7.8852 8.0715 8.0715 8.1058 8.1058 8.2255 8.2255 8.2344 8.2344 9.1768 9.1768 9.1988 9.1988 9.6559 9.6559 9.7077 9.7077 11.4538 11.4538 11.4683 11.4683 k = 0.0833 0.5000 0.2280 ( 15908 PWs) bands (ev): -69.8695 -69.8695 -69.8695 -69.8695 -39.6423 -39.6423 -39.6423 -39.6423 -38.4795 -38.4795 -38.4795 -38.4795 -38.3882 -38.3882 -38.3882 -38.3882 -19.4890 -19.4890 -19.4890 -19.4890 -15.8863 -15.8863 -15.8851 -15.8851 -6.1569 -6.1569 -6.1029 -6.1029 -4.2517 -4.2517 -4.2512 -4.2512 -4.1435 -4.1435 -4.0657 -4.0657 -0.3553 -0.3553 -0.3544 -0.3544 2.4810 2.4810 2.5309 2.5309 2.5388 2.5388 2.5674 2.5674 2.7507 2.7507 2.8116 2.8116 4.9633 4.9633 4.9658 4.9658 6.3406 6.3406 6.4141 6.4141 6.6250 6.6250 6.6674 6.6674 7.8551 7.8551 7.8694 7.8694 8.0695 8.0695 8.1051 8.1051 8.2314 8.2314 8.2396 8.2396 9.1369 9.1369 9.1567 9.1567 9.6609 9.6609 9.7141 9.7141 11.4781 11.4781 11.4923 11.4923 k = 0.0972 0.5000 0.2280 ( 15916 PWs) bands (ev): -69.8697 -69.8697 -69.8697 -69.8697 -39.6423 -39.6423 -39.6423 -39.6423 -38.4795 -38.4795 -38.4795 -38.4795 -38.3882 -38.3882 -38.3881 -38.3881 -19.4878 -19.4878 -19.4878 -19.4878 -15.8883 -15.8883 -15.8869 -15.8869 -6.1613 -6.1613 -6.0994 -6.0994 -4.2572 -4.2572 -4.2528 -4.2528 -4.1443 -4.1443 -4.0590 -4.0590 -0.3511 -0.3511 -0.3501 -0.3501 2.4710 2.4710 2.5372 2.5372 2.5389 2.5389 2.5555 2.5555 2.7627 2.7627 2.8254 2.8254 4.9659 4.9659 4.9692 4.9692 6.3300 6.3300 6.4179 6.4179 6.6074 6.6074 6.6592 6.6592 7.8376 7.8376 7.8518 7.8518 8.0643 8.0643 8.0997 8.0997 8.2396 8.2396 8.2459 8.2459 9.0961 9.0961 9.1128 9.1128 9.6626 9.6626 9.7155 9.7155 11.5037 11.5037 11.5160 11.5160 k = 0.1111 0.5000 0.2280 ( 15920 PWs) bands (ev): -69.8699 -69.8699 -69.8699 -69.8699 -39.6423 -39.6423 -39.6423 -39.6423 -38.4796 -38.4796 -38.4795 -38.4795 -38.3881 -38.3881 -38.3881 -38.3881 -19.4864 -19.4864 -19.4864 -19.4864 -15.8905 -15.8905 -15.8890 -15.8890 -6.1657 -6.1657 -6.0962 -6.0962 -4.2635 -4.2635 -4.2543 -4.2543 -4.1441 -4.1441 -4.0529 -4.0529 -0.3464 -0.3464 -0.3453 -0.3453 2.4599 2.4599 2.5401 2.5401 2.5414 2.5414 2.5472 2.5472 2.7753 2.7753 2.8389 2.8389 4.9684 4.9684 4.9727 4.9727 6.3184 6.3184 6.4214 6.4214 6.5890 6.5890 6.6508 6.6508 7.8194 7.8194 7.8331 7.8331 8.0557 8.0557 8.0895 8.0895 8.2514 8.2514 8.2552 8.2552 9.0562 9.0562 9.0695 9.0695 9.6617 9.6617 9.7128 9.7128 11.5296 11.5296 11.5386 11.5386 k = 0.1250 0.5000 0.2280 ( 15920 PWs) bands (ev): -69.8699 -69.8699 -69.8699 -69.8699 -39.6424 -39.6424 -39.6423 -39.6423 -38.4796 -38.4796 -38.4796 -38.4796 -38.3881 -38.3881 -38.3881 -38.3881 -19.4849 -19.4849 -19.4849 -19.4849 -15.8930 -15.8930 -15.8914 -15.8914 -6.1698 -6.1698 -6.0933 -6.0933 -4.2705 -4.2705 -4.2555 -4.2555 -4.1430 -4.1430 -4.0475 -4.0475 -0.3412 -0.3412 -0.3399 -0.3399 2.4486 2.4486 2.5287 2.5287 2.5455 2.5455 2.5537 2.5537 2.7881 2.7881 2.8520 2.8520 4.9705 4.9705 4.9760 4.9760 6.3059 6.3059 6.4253 6.4253 6.5687 6.5687 6.6423 6.6423 7.8015 7.8015 7.8150 7.8150 8.0454 8.0454 8.0771 8.0771 8.2642 8.2642 8.2651 8.2651 9.0184 9.0184 9.0281 9.0281 9.6565 9.6565 9.7050 9.7050 11.5552 11.5552 11.5603 11.5603 k = 0.1389 0.5000 0.2280 ( 15916 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6424 -39.6424 -39.6423 -39.6423 -38.4796 -38.4796 -38.4796 -38.4796 -38.3881 -38.3881 -38.3880 -38.3880 -19.4832 -19.4832 -19.4832 -19.4832 -15.8957 -15.8957 -15.8939 -15.8939 -6.1736 -6.1736 -6.0907 -6.0907 -4.2777 -4.2777 -4.2565 -4.2565 -4.1412 -4.1412 -4.0428 -4.0428 -0.3354 -0.3354 -0.3341 -0.3341 2.4373 2.4373 2.5160 2.5160 2.5510 2.5510 2.5622 2.5622 2.8009 2.8009 2.8645 2.8645 4.9721 4.9721 4.9788 4.9788 6.2926 6.2926 6.4291 6.4291 6.5478 6.5478 6.6338 6.6338 7.7840 7.7840 7.7974 7.7974 8.0320 8.0320 8.0619 8.0619 8.2767 8.2767 8.2785 8.2785 8.9821 8.9821 8.9884 8.9884 9.6491 9.6491 9.6942 9.6942 11.5798 11.5798 11.5807 11.5807 k = 0.1528 0.5000 0.2280 ( 15908 PWs) bands (ev): -69.8696 -69.8696 -69.8696 -69.8696 -39.6424 -39.6424 -39.6423 -39.6423 -38.4797 -38.4797 -38.4796 -38.4796 -38.3880 -38.3880 -38.3880 -38.3880 -19.4815 -19.4815 -19.4815 -19.4815 -15.8987 -15.8987 -15.8967 -15.8967 -6.1773 -6.1773 -6.0885 -6.0885 -4.2851 -4.2851 -4.2573 -4.2573 -4.1389 -4.1389 -4.0389 -4.0389 -0.3292 -0.3292 -0.3278 -0.3278 2.4265 2.4265 2.5035 2.5035 2.5577 2.5577 2.5716 2.5716 2.8134 2.8134 2.8764 2.8764 4.9730 4.9730 4.9811 4.9811 6.2786 6.2786 6.4324 6.4324 6.5264 6.5264 6.6251 6.6251 7.7685 7.7685 7.7813 7.7813 8.0172 8.0172 8.0444 8.0444 8.2881 8.2881 8.2925 8.2925 8.9471 8.9471 8.9501 8.9501 9.6391 9.6391 9.6802 9.6802 11.6010 11.6010 11.6039 11.6039 k = 0.1667 0.5000 0.2280 ( 15912 PWs) bands (ev): -69.8697 -69.8697 -69.8697 -69.8697 -39.6424 -39.6424 -39.6423 -39.6423 -38.4797 -38.4797 -38.4797 -38.4797 -38.3880 -38.3880 -38.3879 -38.3879 -19.4796 -19.4796 -19.4795 -19.4795 -15.9017 -15.9017 -15.8997 -15.8997 -6.1806 -6.1806 -6.0866 -6.0866 -4.2924 -4.2924 -4.2579 -4.2579 -4.1363 -4.1363 -4.0358 -4.0358 -0.3225 -0.3225 -0.3210 -0.3210 2.4162 2.4162 2.4913 2.4913 2.5653 2.5653 2.5817 2.5817 2.8254 2.8254 2.8877 2.8877 4.9727 4.9727 4.9823 4.9823 6.2636 6.2636 6.4354 6.4354 6.5042 6.5042 6.6167 6.6167 7.7518 7.7518 7.7642 7.7642 8.0000 8.0000 8.0247 8.0247 8.2984 8.2984 8.3054 8.3054 8.9137 8.9137 8.9138 8.9138 9.6248 9.6248 9.6617 9.6617 11.6204 11.6204 11.6265 11.6265 k = 0.1806 0.5000 0.2280 ( 15916 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6424 -39.6424 -39.6423 -39.6423 -38.4798 -38.4798 -38.4797 -38.4797 -38.3879 -38.3879 -38.3879 -38.3879 -19.4775 -19.4775 -19.4775 -19.4775 -15.9050 -15.9050 -15.9028 -15.9028 -6.1836 -6.1836 -6.0852 -6.0852 -4.2995 -4.2995 -4.2582 -4.2582 -4.1335 -4.1335 -4.0336 -4.0336 -0.3155 -0.3155 -0.3139 -0.3139 2.4066 2.4066 2.4797 2.4797 2.5738 2.5738 2.5923 2.5923 2.8370 2.8370 2.8982 2.8982 4.9712 4.9712 4.9824 4.9824 6.2484 6.2484 6.4371 6.4371 6.4834 6.4834 6.6086 6.6086 7.7358 7.7358 7.7475 7.7475 7.9802 7.9802 8.0022 8.0022 8.3088 8.3088 8.3181 8.3181 8.8795 8.8795 8.8820 8.8820 9.6096 9.6096 9.6421 9.6421 11.6391 11.6391 11.6475 11.6475 k = 0.1944 0.5000 0.2280 ( 15920 PWs) bands (ev): -69.8699 -69.8699 -69.8699 -69.8699 -39.6424 -39.6424 -39.6423 -39.6423 -38.4798 -38.4798 -38.4798 -38.4798 -38.3879 -38.3879 -38.3879 -38.3879 -19.4755 -19.4755 -19.4755 -19.4755 -15.9083 -15.9083 -15.9061 -15.9061 -6.1863 -6.1863 -6.0841 -6.0841 -4.3063 -4.3063 -4.2583 -4.2583 -4.1306 -4.1306 -4.0322 -4.0322 -0.3082 -0.3082 -0.3065 -0.3065 2.3978 2.3978 2.4686 2.4686 2.5831 2.5831 2.6036 2.6036 2.8479 2.8479 2.9080 2.9080 4.9683 4.9683 4.9810 4.9810 6.2331 6.2331 6.4355 6.4355 6.4660 6.4660 6.6012 6.6012 7.7212 7.7212 7.7324 7.7324 7.9598 7.9598 7.9790 7.9790 8.3183 8.3183 8.3297 8.3297 8.8471 8.8471 8.8518 8.8518 9.5918 9.5918 9.6197 9.6197 11.6574 11.6574 11.6673 11.6673 k = 0.2083 0.5000 0.2280 ( 15908 PWs) bands (ev): -69.8695 -69.8695 -69.8695 -69.8695 -39.6424 -39.6424 -39.6424 -39.6424 -38.4799 -38.4799 -38.4798 -38.4798 -38.3879 -38.3879 -38.3878 -38.3878 -19.4733 -19.4733 -19.4733 -19.4733 -15.9118 -15.9118 -15.9095 -15.9095 -6.1886 -6.1886 -6.0834 -6.0834 -4.3125 -4.3125 -4.2583 -4.2583 -4.1277 -4.1277 -4.0316 -4.0316 -0.3005 -0.3005 -0.2989 -0.2989 2.3898 2.3898 2.4582 2.4582 2.5932 2.5932 2.6153 2.6153 2.8583 2.8583 2.9171 2.9171 4.9637 4.9637 4.9780 4.9780 6.2182 6.2182 6.4252 6.4252 6.4588 6.4588 6.5953 6.5953 7.7076 7.7076 7.7183 7.7183 7.9392 7.9392 7.9556 7.9556 8.3292 8.3292 8.3428 8.3428 8.8190 8.8190 8.8258 8.8258 9.5737 9.5737 9.5973 9.5973 11.6751 11.6751 11.6861 11.6861 k = 0.2222 0.5000 0.2280 ( 15908 PWs) bands (ev): -69.8695 -69.8695 -69.8695 -69.8695 -39.6425 -39.6425 -39.6424 -39.6424 -38.4799 -38.4799 -38.4799 -38.4799 -38.3878 -38.3878 -38.3878 -38.3878 -19.4711 -19.4711 -19.4711 -19.4711 -15.9153 -15.9153 -15.9130 -15.9130 -6.1905 -6.1905 -6.0832 -6.0832 -4.3183 -4.3183 -4.2581 -4.2581 -4.1249 -4.1249 -4.0319 -4.0319 -0.2927 -0.2927 -0.2910 -0.2910 2.3827 2.3827 2.4486 2.4486 2.6039 2.6039 2.6276 2.6276 2.8679 2.8679 2.9254 2.9254 4.9573 4.9573 4.9730 4.9730 6.2039 6.2039 6.4075 6.4075 6.4595 6.4595 6.5898 6.5898 7.6924 7.6924 7.7024 7.7024 7.9162 7.9162 7.9298 7.9298 8.3385 8.3385 8.3543 8.3543 8.7929 8.7929 8.8015 8.8015 9.5558 9.5558 9.5754 9.5754 11.6913 11.6913 11.7032 11.7032 k = 0.2361 0.5000 0.2280 ( 15912 PWs) bands (ev): -69.8697 -69.8697 -69.8697 -69.8697 -39.6425 -39.6425 -39.6424 -39.6424 -38.4800 -38.4800 -38.4799 -38.4799 -38.3878 -38.3878 -38.3877 -38.3877 -19.4688 -19.4688 -19.4688 -19.4688 -15.9189 -15.9189 -15.9166 -15.9166 -6.1921 -6.1921 -6.0834 -6.0834 -4.3234 -4.3234 -4.2577 -4.2577 -4.1221 -4.1221 -4.0329 -4.0329 -0.2847 -0.2847 -0.2831 -0.2831 2.3765 2.3765 2.4396 2.4396 2.6153 2.6153 2.6402 2.6402 2.8769 2.8769 2.9329 2.9329 4.9491 4.9491 4.9661 4.9661 6.1903 6.1903 6.3881 6.3881 6.4628 6.4628 6.5852 6.5852 7.6792 7.6792 7.6888 7.6888 7.8938 7.8938 7.9047 7.9047 8.3453 8.3453 8.3631 8.3631 8.7665 8.7665 8.7765 8.7765 9.5366 9.5366 9.5524 9.5524 11.7069 11.7069 11.7198 11.7198 k = 0.2500 0.5000 0.2280 ( 15912 PWs) bands (ev): -69.8696 -69.8696 -69.8696 -69.8696 -39.6425 -39.6425 -39.6424 -39.6424 -38.4800 -38.4800 -38.4800 -38.4800 -38.3877 -38.3877 -38.3877 -38.3877 -19.4665 -19.4665 -19.4665 -19.4665 -15.9225 -15.9225 -15.9202 -15.9202 -6.1932 -6.1932 -6.0839 -6.0839 -4.3279 -4.3279 -4.2573 -4.2573 -4.1194 -4.1194 -4.0347 -4.0347 -0.2767 -0.2767 -0.2750 -0.2750 2.3711 2.3711 2.4314 2.4314 2.6272 2.6272 2.6532 2.6532 2.8851 2.8851 2.9396 2.9396 4.9391 4.9391 4.9571 4.9571 6.1780 6.1780 6.3691 6.3691 6.4671 6.4671 6.5812 6.5812 7.6676 7.6676 7.6768 7.6768 7.8714 7.8714 7.8800 7.8800 8.3517 8.3517 8.3713 8.3713 8.7413 8.7413 8.7526 8.7526 9.5178 9.5178 9.5302 9.5302 11.7215 11.7215 11.7355 11.7355 k = 0.2639 0.5000 0.2280 ( 15888 PWs) bands (ev): -69.8689 -69.8689 -69.8689 -69.8689 -39.6425 -39.6425 -39.6424 -39.6424 -38.4800 -38.4800 -38.4800 -38.4800 -38.3877 -38.3877 -38.3876 -38.3876 -19.4643 -19.4643 -19.4642 -19.4642 -15.9262 -15.9262 -15.9238 -15.9238 -6.1939 -6.1939 -6.0849 -6.0849 -4.3317 -4.3317 -4.2568 -4.2568 -4.1169 -4.1169 -4.0371 -4.0371 -0.2686 -0.2686 -0.2669 -0.2669 2.3666 2.3666 2.4240 2.4240 2.6396 2.6396 2.6665 2.6665 2.8926 2.8926 2.9456 2.9456 4.9275 4.9275 4.9462 4.9462 6.1674 6.1674 6.3515 6.3515 6.4721 6.4721 6.5782 6.5782 7.6584 7.6584 7.6673 7.6673 7.8499 7.8499 7.8564 7.8564 8.3603 8.3603 8.3815 8.3815 8.7202 8.7202 8.7326 8.7326 9.5020 9.5020 9.5113 9.5113 11.7351 11.7351 11.7506 11.7506 k = 0.2778 0.5000 0.2280 ( 15900 PWs) bands (ev): -69.8693 -69.8693 -69.8693 -69.8693 -39.6425 -39.6425 -39.6424 -39.6424 -38.4801 -38.4801 -38.4801 -38.4801 -38.3876 -38.3876 -38.3876 -38.3876 -19.4620 -19.4620 -19.4620 -19.4620 -15.9297 -15.9297 -15.9274 -15.9274 -6.1942 -6.1942 -6.0863 -6.0863 -4.3347 -4.3347 -4.2564 -4.2564 -4.1145 -4.1145 -4.0402 -4.0402 -0.2605 -0.2605 -0.2589 -0.2589 2.3629 2.3629 2.4172 2.4172 2.6524 2.6524 2.6800 2.6800 2.8994 2.8994 2.9507 2.9507 4.9138 4.9138 4.9330 4.9330 6.1582 6.1582 6.3345 6.3345 6.4770 6.4770 6.5751 6.5751 7.6475 7.6475 7.6561 7.6561 7.8266 7.8266 7.8313 7.8313 8.3640 8.3640 8.3868 8.3868 8.6978 8.6978 8.7111 8.7111 9.4828 9.4828 9.4893 9.4893 11.7471 11.7471 11.7643 11.7643 k = 0.2917 0.5000 0.2280 ( 15912 PWs) bands (ev): -69.8696 -69.8696 -69.8696 -69.8696 -39.6425 -39.6425 -39.6424 -39.6424 -38.4802 -38.4802 -38.4801 -38.4801 -38.3876 -38.3876 -38.3875 -38.3875 -19.4597 -19.4597 -19.4597 -19.4597 -15.9333 -15.9333 -15.9310 -15.9310 -6.1940 -6.1940 -6.0881 -6.0881 -4.3370 -4.3370 -4.2559 -4.2559 -4.1124 -4.1124 -4.0437 -4.0437 -0.2525 -0.2525 -0.2509 -0.2509 2.3601 2.3601 2.4112 2.4112 2.6655 2.6655 2.6936 2.6936 2.9054 2.9054 2.9550 2.9550 4.8987 4.8987 4.9181 4.9181 6.1506 6.1506 6.3185 6.3185 6.4829 6.4829 6.5732 6.5732 7.6377 7.6377 7.6458 7.6458 7.8047 7.8047 7.8071 7.8071 8.3649 8.3649 8.3893 8.3893 8.6754 8.6754 8.6894 8.6894 9.4655 9.4655 9.4697 9.4697 11.7581 11.7581 11.7771 11.7771 k = 0.3056 0.5000 0.2280 ( 15916 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6425 -39.6425 -39.6425 -39.6425 -38.4802 -38.4802 -38.4802 -38.4802 -38.3875 -38.3875 -38.3875 -38.3875 -19.4575 -19.4575 -19.4575 -19.4575 -15.9367 -15.9367 -15.9345 -15.9345 -6.1935 -6.1935 -6.0903 -6.0903 -4.3385 -4.3385 -4.2557 -4.2557 -4.1105 -4.1105 -4.0478 -4.0478 -0.2447 -0.2447 -0.2432 -0.2432 2.3579 2.3579 2.4059 2.4059 2.6788 2.6788 2.7073 2.7073 2.9107 2.9107 2.9585 2.9585 4.8824 4.8824 4.9017 4.9017 6.1447 6.1447 6.3038 6.3038 6.4893 6.4893 6.5721 6.5721 7.6295 7.6295 7.6370 7.6370 7.7836 7.7836 7.7842 7.7842 8.3651 8.3651 8.3908 8.3908 8.6549 8.6549 8.6694 8.6694 9.4515 9.4515 9.4538 9.4538 11.7682 11.7682 11.7891 11.7891 k = 0.3194 0.5000 0.2280 ( 15908 PWs) bands (ev): -69.8695 -69.8695 -69.8695 -69.8695 -39.6426 -39.6426 -39.6425 -39.6425 -38.4803 -38.4803 -38.4802 -38.4802 -38.3875 -38.3875 -38.3874 -38.3874 -19.4554 -19.4554 -19.4554 -19.4554 -15.9400 -15.9400 -15.9379 -15.9379 -6.1925 -6.1925 -6.0929 -6.0929 -4.3393 -4.3393 -4.2556 -4.2556 -4.1087 -4.1087 -4.0521 -4.0521 -0.2371 -0.2371 -0.2356 -0.2356 2.3565 2.3565 2.4012 2.4012 2.6922 2.6922 2.7208 2.7208 2.9152 2.9152 2.9613 2.9613 4.8654 4.8654 4.8842 4.8842 6.1406 6.1406 6.2902 6.2902 6.4960 6.4960 6.5715 6.5715 7.6231 7.6231 7.6303 7.6303 7.7629 7.7629 7.7636 7.7636 8.3644 8.3644 8.3911 8.3911 8.6375 8.6375 8.6524 8.6524 9.4408 9.4408 9.4417 9.4417 11.7779 11.7779 11.8006 11.8006 k = 0.3333 0.5000 0.2280 ( 15912 PWs) bands (ev): -69.8697 -69.8697 -69.8697 -69.8697 -39.6426 -39.6426 -39.6425 -39.6425 -38.4803 -38.4803 -38.4803 -38.4803 -38.3875 -38.3875 -38.3874 -38.3874 -19.4534 -19.4534 -19.4534 -19.4534 -15.9432 -15.9432 -15.9412 -15.9412 -6.1910 -6.1910 -6.0958 -6.0958 -4.3393 -4.3393 -4.2558 -4.2558 -4.1072 -4.1072 -4.0567 -4.0567 -0.2298 -0.2298 -0.2283 -0.2283 2.3557 2.3557 2.3971 2.3971 2.7057 2.7057 2.7342 2.7342 2.9191 2.9191 2.9633 2.9633 4.8477 4.8477 4.8658 4.8658 6.1379 6.1379 6.2776 6.2776 6.5032 6.5032 6.5715 6.5715 7.6183 7.6183 7.6248 7.6248 7.7428 7.7428 7.7450 7.7450 8.3606 8.3606 8.3880 8.3880 8.6180 8.6180 8.6330 8.6330 9.4289 9.4289 9.4292 9.4292 11.7877 11.7877 11.8116 11.8116 k = 0.3472 0.5000 0.2280 ( 15908 PWs) bands (ev): -69.8695 -69.8695 -69.8695 -69.8695 -39.6426 -39.6426 -39.6425 -39.6425 -38.4803 -38.4803 -38.4803 -38.4803 -38.3874 -38.3874 -38.3874 -38.3874 -19.4514 -19.4514 -19.4514 -19.4514 -15.9462 -15.9462 -15.9443 -15.9443 -6.1892 -6.1892 -6.0990 -6.0990 -4.3385 -4.3385 -4.2563 -4.2563 -4.1058 -4.1058 -4.0614 -4.0614 -0.2228 -0.2228 -0.2214 -0.2214 2.3555 2.3555 2.3935 2.3935 2.7190 2.7190 2.7473 2.7473 2.9223 2.9223 2.9645 2.9645 4.8295 4.8295 4.8467 4.8467 6.1368 6.1368 6.2661 6.2661 6.5106 6.5106 6.5720 6.5720 7.6132 7.6132 7.6191 7.6191 7.7238 7.7238 7.7271 7.7271 8.3580 8.3580 8.3857 8.3857 8.6036 8.6036 8.6185 8.6185 9.4179 9.4179 9.4191 9.4191 11.7975 11.7975 11.8223 11.8223 k = 0.3611 0.5000 0.2280 ( 15916 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6426 -39.6426 -39.6425 -39.6425 -38.4804 -38.4804 -38.4803 -38.4803 -38.3874 -38.3874 -38.3874 -38.3874 -19.4496 -19.4496 -19.4496 -19.4496 -15.9491 -15.9491 -15.9473 -15.9473 -6.1870 -6.1870 -6.1026 -6.1026 -4.3370 -4.3370 -4.2572 -4.2572 -4.1046 -4.1046 -4.0662 -4.0662 -0.2162 -0.2162 -0.2149 -0.2149 2.3558 2.3558 2.3904 2.3904 2.7322 2.7322 2.7600 2.7600 2.9250 2.9250 2.9650 2.9650 4.8115 4.8115 4.8275 4.8275 6.1369 6.1369 6.2554 6.2554 6.5181 6.5181 6.5728 6.5728 7.6089 7.6089 7.6136 7.6136 7.7040 7.7040 7.7088 7.7088 8.3531 8.3531 8.3805 8.3805 8.5892 8.5892 8.6036 8.6036 9.4082 9.4082 9.4101 9.4101 11.8076 11.8076 11.8329 11.8329 k = 0.3750 0.5000 0.2280 ( 15916 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6426 -39.6426 -39.6425 -39.6425 -38.4804 -38.4804 -38.4804 -38.4804 -38.3874 -38.3874 -38.3873 -38.3873 -19.4479 -19.4479 -19.4479 -19.4479 -15.9517 -15.9517 -15.9500 -15.9500 -6.1844 -6.1844 -6.1064 -6.1064 -4.3348 -4.3348 -4.2585 -4.2585 -4.1036 -4.1036 -4.0708 -4.0708 -0.2100 -0.2100 -0.2089 -0.2089 2.3566 2.3566 2.3877 2.3877 2.7451 2.7451 2.7721 2.7721 2.9271 2.9271 2.9648 2.9648 4.7940 4.7940 4.8086 4.8086 6.1381 6.1381 6.2453 6.2453 6.5258 6.5258 6.5740 6.5740 7.6060 7.6060 7.6099 7.6099 7.6881 7.6881 7.6936 7.6936 8.3471 8.3471 8.3736 8.3736 8.5763 8.5763 8.5900 8.5900 9.4014 9.4014 9.4036 9.4036 11.8185 11.8185 11.8440 11.8440 k = 0.3889 0.5000 0.2280 ( 15912 PWs) bands (ev): -69.8697 -69.8697 -69.8697 -69.8697 -39.6426 -39.6426 -39.6425 -39.6425 -38.4804 -38.4804 -38.4804 -38.4804 -38.3873 -38.3873 -38.3873 -38.3873 -19.4463 -19.4463 -19.4463 -19.4463 -15.9541 -15.9541 -15.9526 -15.9526 -6.1814 -6.1814 -6.1105 -6.1105 -4.3320 -4.3320 -4.2604 -4.2604 -4.1028 -4.1028 -4.0752 -4.0752 -0.2044 -0.2044 -0.2033 -0.2033 2.3576 2.3576 2.3853 2.3853 2.7575 2.7575 2.7834 2.7834 2.9287 2.9287 2.9640 2.9640 4.7772 4.7772 4.7904 4.7904 6.1402 6.1402 6.2360 6.2360 6.5334 6.5334 6.5753 6.5753 7.6038 7.6038 7.6065 7.6065 7.6722 7.6722 7.6788 7.6788 8.3419 8.3419 8.3669 8.3669 8.5686 8.5686 8.5812 8.5812 9.3944 9.3944 9.3969 9.3969 11.8304 11.8304 11.8557 11.8557 k = 0.4028 0.5000 0.2280 ( 15912 PWs) bands (ev): -69.8697 -69.8697 -69.8697 -69.8697 -39.6426 -39.6426 -39.6425 -39.6425 -38.4805 -38.4805 -38.4804 -38.4804 -38.3873 -38.3873 -38.3873 -38.3873 -19.4449 -19.4449 -19.4449 -19.4449 -15.9562 -15.9562 -15.9549 -15.9549 -6.1782 -6.1782 -6.1148 -6.1148 -4.3286 -4.3286 -4.2628 -4.2628 -4.1020 -4.1020 -4.0793 -4.0793 -0.1992 -0.1992 -0.1983 -0.1983 2.3590 2.3590 2.3833 2.3833 2.7693 2.7693 2.7939 2.7939 2.9299 2.9299 2.9625 2.9625 4.7614 4.7614 4.7731 4.7731 6.1431 6.1431 6.2272 6.2272 6.5408 6.5408 6.5768 6.5768 7.6021 7.6021 7.6036 7.6036 7.6584 7.6584 7.6658 7.6658 8.3349 8.3349 8.3579 8.3579 8.5619 8.5619 8.5732 8.5732 9.3889 9.3889 9.3914 9.3914 11.8434 11.8434 11.8682 11.8682 k = 0.4167 0.5000 0.2280 ( 15912 PWs) bands (ev): -69.8697 -69.8697 -69.8697 -69.8697 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3873 -38.3873 -38.3872 -38.3872 -19.4436 -19.4436 -19.4436 -19.4436 -15.9581 -15.9581 -15.9570 -15.9570 -6.1746 -6.1746 -6.1193 -6.1193 -4.3246 -4.3246 -4.2658 -4.2658 -4.1014 -4.1014 -4.0831 -4.0831 -0.1947 -0.1947 -0.1939 -0.1939 2.3606 2.3606 2.3814 2.3814 2.7805 2.7805 2.8032 2.8032 2.9310 2.9310 2.9604 2.9604 4.7472 4.7472 4.7573 4.7573 6.1466 6.1466 6.2188 6.2188 6.5478 6.5478 6.5781 6.5781 7.6010 7.6010 7.6013 7.6013 7.6459 7.6459 7.6539 7.6539 8.3283 8.3283 8.3488 8.3488 8.5569 8.5569 8.5666 8.5666 9.3844 9.3844 9.3868 9.3868 11.8574 11.8574 11.8813 11.8813 k = 0.4306 0.5000 0.2280 ( 15912 PWs) bands (ev): -69.8697 -69.8697 -69.8697 -69.8697 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4426 -19.4426 -19.4426 -19.4426 -15.9597 -15.9597 -15.9587 -15.9587 -6.1707 -6.1707 -6.1240 -6.1240 -4.3201 -4.3201 -4.2694 -4.2694 -4.1008 -4.1008 -4.0864 -4.0864 -0.1908 -0.1908 -0.1901 -0.1901 2.3624 2.3624 2.3797 2.3797 2.7908 2.7908 2.8111 2.8111 2.9320 2.9320 2.9579 2.9579 4.7348 4.7348 4.7433 4.7433 6.1506 6.1506 6.2110 6.2110 6.5543 6.5543 6.5792 6.5792 7.5995 7.5995 7.6006 7.6006 7.6351 7.6351 7.6435 7.6435 8.3226 8.3226 8.3402 8.3402 8.5528 8.5528 8.5610 8.5610 9.3814 9.3814 9.3835 9.3835 11.8721 11.8721 11.8947 11.8947 k = 0.4444 0.5000 0.2280 ( 15920 PWs) bands (ev): -69.8700 -69.8700 -69.8700 -69.8700 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4417 -19.4417 -19.4417 -19.4417 -15.9610 -15.9610 -15.9602 -15.9602 -6.1666 -6.1666 -6.1287 -6.1287 -4.3153 -4.3153 -4.2734 -4.2734 -4.1002 -4.1002 -4.0893 -4.0893 -0.1876 -0.1876 -0.1870 -0.1870 2.3642 2.3642 2.3780 2.3780 2.8001 2.8001 2.8175 2.8175 2.9332 2.9332 2.9550 2.9550 4.7244 4.7244 4.7312 4.7312 6.1550 6.1550 6.2033 6.2033 6.5602 6.5602 6.5798 6.5798 7.5985 7.5985 7.6010 7.6010 7.6255 7.6255 7.6342 7.6342 8.3157 8.3157 8.3302 8.3302 8.5491 8.5491 8.5555 8.5555 9.3784 9.3784 9.3802 9.3802 11.8874 11.8874 11.9081 11.9081 k = 0.4583 0.5000 0.2280 ( 15916 PWs) bands (ev): -69.8699 -69.8699 -69.8699 -69.8699 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4410 -19.4410 -19.4410 -19.4410 -15.9620 -15.9620 -15.9614 -15.9614 -6.1622 -6.1622 -6.1336 -6.1336 -4.3101 -4.3101 -4.2780 -4.2780 -4.0995 -4.0995 -4.0918 -4.0918 -0.1850 -0.1850 -0.1846 -0.1846 2.3661 2.3661 2.3765 2.3765 2.8082 2.8082 2.8221 2.8221 2.9346 2.9346 2.9517 2.9517 4.7167 4.7167 4.7218 4.7218 6.1600 6.1600 6.1962 6.1962 6.5656 6.5656 6.5800 6.5800 7.5984 7.5984 7.6027 7.6027 7.6178 7.6178 7.6268 7.6268 8.3123 8.3123 8.3234 8.3234 8.5452 8.5452 8.5500 8.5500 9.3790 9.3790 9.3804 9.3804 11.9030 11.9030 11.9207 11.9207 k = 0.4722 0.5000 0.2280 ( 15928 PWs) bands (ev): -69.8702 -69.8702 -69.8702 -69.8702 -39.6426 -39.6426 -39.6426 -39.6426 -38.4806 -38.4806 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4405 -19.4405 -19.4405 -19.4405 -15.9627 -15.9627 -15.9623 -15.9623 -6.1577 -6.1577 -6.1385 -6.1385 -4.3047 -4.3047 -4.2829 -4.2829 -4.0988 -4.0988 -4.0938 -4.0938 -0.1831 -0.1831 -0.1828 -0.1828 2.3679 2.3679 2.3749 2.3749 2.8150 2.8150 2.8246 2.8246 2.9365 2.9365 2.9483 2.9483 4.7108 4.7108 4.7143 4.7143 6.1652 6.1652 6.1893 6.1893 6.5700 6.5700 6.5795 6.5795 7.5983 7.5983 7.6036 7.6036 7.6116 7.6116 7.6201 7.6201 8.3089 8.3089 8.3164 8.3164 8.5418 8.5418 8.5450 8.5450 9.3765 9.3765 9.3774 9.3774 11.9171 11.9171 11.9304 11.9304 k = 0.4861 0.5000 0.2280 ( 15912 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4402 -19.4402 -19.4402 -19.4402 -15.9631 -15.9631 -15.9629 -15.9629 -6.1530 -6.1530 -6.1434 -6.1434 -4.2992 -4.2992 -4.2882 -4.2882 -4.0979 -4.0979 -4.0955 -4.0955 -0.1820 -0.1820 -0.1818 -0.1818 2.3697 2.3697 2.3732 2.3732 2.8202 2.8202 2.8252 2.8252 2.9389 2.9389 2.9449 2.9449 4.7080 4.7080 4.7097 4.7097 6.1709 6.1709 6.1830 6.1830 6.5736 6.5736 6.5784 6.5784 7.6005 7.6005 7.6049 7.6049 7.6096 7.6096 7.6156 7.6156 8.3113 8.3113 8.3151 8.3151 8.5412 8.5412 8.5429 8.5429 9.3785 9.3785 9.3790 9.3790 11.9285 11.9285 11.9358 11.9358 k = 0.5000 0.5000 0.2280 ( 15904 PWs) bands (ev): -69.8695 -69.8695 -69.8695 -69.8695 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1482 -6.1482 -6.1482 -6.1482 -4.2936 -4.2936 -4.2936 -4.2936 -4.0969 -4.0969 -4.0969 -4.0969 -0.1815 -0.1815 -0.1815 -0.1815 2.3715 2.3715 2.3715 2.3715 2.8236 2.8236 2.8236 2.8236 2.9417 2.9417 2.9417 2.9417 4.7075 4.7075 4.7075 4.7075 6.1769 6.1769 6.1769 6.1769 6.5764 6.5764 6.5764 6.5764 7.6037 7.6037 7.6037 7.6037 7.6124 7.6124 7.6124 7.6124 8.3130 8.3130 8.3130 8.3130 8.5426 8.5426 8.5426 8.5426 9.3786 9.3786 9.3786 9.3786 11.9351 11.9351 11.9351 11.9351 k = 0.5000 0.5000 0.2280 ( 15904 PWs) bands (ev): -69.8695 -69.8695 -69.8695 -69.8695 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1482 -6.1482 -6.1482 -6.1482 -4.2936 -4.2936 -4.2936 -4.2936 -4.0969 -4.0969 -4.0969 -4.0969 -0.1815 -0.1815 -0.1815 -0.1815 2.3715 2.3715 2.3715 2.3715 2.8236 2.8236 2.8236 2.8236 2.9417 2.9417 2.9417 2.9417 4.7075 4.7075 4.7075 4.7075 6.1769 6.1769 6.1769 6.1769 6.5764 6.5764 6.5764 6.5764 7.6037 7.6037 7.6037 7.6037 7.6124 7.6124 7.6124 7.6124 8.3130 8.3130 8.3130 8.3130 8.5426 8.5426 8.5426 8.5426 9.3786 9.3786 9.3786 9.3786 11.9351 11.9351 11.9351 11.9351 k = 0.4900 0.4900 0.2280 ( 15916 PWs) bands (ev): -69.8700 -69.8700 -69.8698 -69.8698 -39.6426 -39.6426 -39.6426 -39.6426 -38.4806 -38.4806 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4403 -19.4403 -19.4401 -19.4401 -15.9631 -15.9631 -15.9629 -15.9629 -6.1531 -6.1531 -6.1433 -6.1433 -4.2993 -4.2993 -4.2881 -4.2881 -4.0980 -4.0980 -4.0955 -4.0955 -0.1823 -0.1823 -0.1815 -0.1815 2.3697 2.3697 2.3733 2.3733 2.8200 2.8200 2.8252 2.8252 2.9387 2.9387 2.9451 2.9451 4.7080 4.7080 4.7098 4.7098 6.1708 6.1708 6.1831 6.1831 6.5734 6.5734 6.5786 6.5786 7.6001 7.6001 7.6053 7.6053 7.6090 7.6090 7.6156 7.6156 8.3101 8.3101 8.3140 8.3140 8.5410 8.5410 8.5427 8.5427 9.3780 9.3780 9.3793 9.3793 11.9263 11.9263 11.9379 11.9379 k = 0.4800 0.4800 0.2280 ( 15918 PWs) bands (ev): -69.8701 -69.8701 -69.8698 -69.8698 -39.6426 -39.6426 -39.6426 -39.6426 -38.4806 -38.4806 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4409 -19.4409 -19.4401 -19.4401 -15.9627 -15.9627 -15.9623 -15.9623 -6.1579 -6.1579 -6.1382 -6.1382 -4.3050 -4.3050 -4.2826 -4.2826 -4.0989 -4.0989 -4.0937 -4.0937 -0.1844 -0.1844 -0.1816 -0.1816 2.3674 2.3674 2.3754 2.3754 2.8145 2.8145 2.8249 2.8249 2.9357 2.9357 2.9490 2.9490 4.7111 4.7111 4.7147 4.7147 6.1650 6.1650 6.1897 6.1897 6.5689 6.5689 6.5806 6.5806 7.5984 7.5984 7.6071 7.6071 7.6082 7.6082 7.6221 7.6221 8.3085 8.3085 8.3206 8.3206 8.5406 8.5406 8.5471 8.5471 9.3773 9.3773 9.3791 9.3791 11.9074 11.9074 11.9414 11.9414 k = 0.4700 0.4700 0.2280 ( 15918 PWs) bands (ev): -69.8701 -69.8701 -69.8697 -69.8697 -39.6427 -39.6427 -39.6425 -39.6425 -38.4807 -38.4807 -38.4804 -38.4804 -38.3872 -38.3872 -38.3872 -38.3872 -19.4419 -19.4419 -19.4401 -19.4401 -15.9620 -15.9620 -15.9613 -15.9613 -6.1626 -6.1626 -6.1332 -6.1332 -4.3108 -4.3108 -4.2772 -4.2772 -4.0999 -4.0999 -4.0914 -4.0914 -0.1881 -0.1881 -0.1818 -0.1818 2.3645 2.3645 2.3781 2.3781 2.8070 2.8070 2.8229 2.8229 2.9323 2.9323 2.9537 2.9537 4.7167 4.7167 4.7224 4.7224 6.1594 6.1594 6.1967 6.1967 6.5624 6.5624 6.5829 6.5829 7.5967 7.5967 7.6066 7.6066 7.6136 7.6136 7.6296 7.6296 8.3077 8.3077 8.3271 8.3271 8.5424 8.5424 8.5553 8.5553 9.3775 9.3775 9.3791 9.3791 11.8816 11.8816 11.9466 11.9466 k = 0.4600 0.4600 0.2280 ( 15914 PWs) bands (ev): -69.8701 -69.8701 -69.8695 -69.8695 -39.6427 -39.6427 -39.6425 -39.6425 -38.4807 -38.4807 -38.4803 -38.4803 -38.3872 -38.3872 -38.3872 -38.3872 -19.4434 -19.4434 -19.4401 -19.4401 -15.9610 -15.9610 -15.9600 -15.9600 -6.1671 -6.1671 -6.1281 -6.1281 -4.3167 -4.3167 -4.2720 -4.2720 -4.1009 -4.1009 -4.0885 -4.0885 -0.1932 -0.1932 -0.1820 -0.1820 2.3611 2.3611 2.3814 2.3814 2.7979 2.7979 2.8194 2.8194 2.9283 2.9283 2.9589 2.9589 4.7251 4.7251 4.7331 4.7331 6.1540 6.1540 6.2041 6.2041 6.5538 6.5538 6.5858 6.5858 7.5953 7.5953 7.6062 7.6062 7.6216 7.6216 7.6390 7.6390 8.3080 8.3080 8.3406 8.3406 8.5412 8.5412 8.5617 8.5617 9.3787 9.3787 9.3834 9.3834 11.8534 11.8534 11.9525 11.9525 k = 0.4500 0.4500 0.2280 ( 15920 PWs) bands (ev): -69.8705 -69.8705 -69.8695 -69.8695 -39.6428 -39.6428 -39.6424 -39.6424 -38.4809 -38.4809 -38.4801 -38.4801 -38.3873 -38.3873 -38.3872 -38.3872 -19.4452 -19.4452 -19.4401 -19.4401 -15.9597 -15.9597 -15.9584 -15.9584 -6.1716 -6.1716 -6.1230 -6.1230 -4.3226 -4.3226 -4.2668 -4.2668 -4.1020 -4.1020 -4.0850 -4.0850 -0.1999 -0.1999 -0.1824 -0.1824 2.3571 2.3571 2.3856 2.3856 2.7874 2.7874 2.8146 2.8146 2.9234 2.9234 2.9645 2.9645 4.7355 4.7355 4.7463 4.7463 6.1486 6.1486 6.2119 6.2119 6.5431 6.5431 6.5893 6.5893 7.5946 7.5946 7.6064 7.6064 7.6296 7.6296 7.6501 7.6501 8.3060 8.3060 8.3576 8.3576 8.5384 8.5384 8.5702 8.5702 9.3779 9.3779 9.3861 9.3861 11.8249 11.8249 11.9577 11.9577 k = 0.4400 0.4400 0.2280 ( 15916 PWs) bands (ev): -69.8708 -69.8708 -69.8689 -69.8689 -39.6429 -39.6429 -39.6423 -39.6423 -38.4810 -38.4810 -38.4800 -38.4800 -38.3873 -38.3873 -38.3872 -38.3872 -19.4475 -19.4475 -19.4401 -19.4401 -15.9581 -15.9581 -15.9564 -15.9564 -6.1758 -6.1758 -6.1179 -6.1179 -4.3285 -4.3285 -4.2616 -4.2616 -4.1031 -4.1031 -4.0810 -4.0810 -0.2081 -0.2081 -0.1829 -0.1829 2.3527 2.3527 2.3907 2.3907 2.7758 2.7758 2.8085 2.8085 2.9177 2.9177 2.9703 2.9703 4.7482 4.7482 4.7624 4.7624 6.1432 6.1432 6.2201 6.2201 6.5304 6.5304 6.5938 6.5938 7.5924 7.5924 7.6073 7.6073 7.6408 7.6408 7.6615 7.6615 8.3056 8.3056 8.3814 8.3814 8.5373 8.5373 8.5810 8.5810 9.3797 9.3797 9.3912 9.3912 11.7971 11.7971 11.9600 11.9600 k = 0.4300 0.4300 0.2280 ( 15904 PWs) bands (ev): -69.8703 -69.8703 -69.8687 -69.8687 -39.6430 -39.6430 -39.6422 -39.6422 -38.4811 -38.4811 -38.4797 -38.4797 -38.3874 -38.3874 -38.3872 -38.3872 -19.4501 -19.4501 -19.4401 -19.4401 -15.9563 -15.9563 -15.9540 -15.9540 -6.1800 -6.1800 -6.1128 -6.1128 -4.3343 -4.3343 -4.2566 -4.2566 -4.1045 -4.1045 -4.0764 -4.0764 -0.2180 -0.2180 -0.1835 -0.1835 2.3481 2.3481 2.3966 2.3966 2.7631 2.7631 2.8013 2.8013 2.9109 2.9109 2.9760 2.9760 4.7630 4.7630 4.7814 4.7814 6.1377 6.1377 6.2287 6.2287 6.5160 6.5160 6.5989 6.5989 7.5922 7.5922 7.6099 7.6099 7.6526 7.6526 7.6758 7.6758 8.3079 8.3079 8.4056 8.4056 8.5358 8.5358 8.5945 8.5945 9.3806 9.3806 9.4015 9.4015 11.7715 11.7715 11.9573 11.9573 k = 0.4200 0.4200 0.2280 ( 15908 PWs) bands (ev): -69.8706 -69.8706 -69.8686 -69.8686 -39.6431 -39.6431 -39.6420 -39.6420 -38.4813 -38.4813 -38.4795 -38.4795 -38.3874 -38.3874 -38.3872 -38.3872 -19.4532 -19.4532 -19.4402 -19.4402 -15.9541 -15.9541 -15.9514 -15.9514 -6.1839 -6.1839 -6.1077 -6.1077 -4.3400 -4.3400 -4.2516 -4.2516 -4.1059 -4.1059 -4.0714 -4.0714 -0.2294 -0.2294 -0.1843 -0.1843 2.3435 2.3435 2.4035 2.4035 2.7497 2.7497 2.7931 2.7931 2.9031 2.9031 2.9816 2.9816 4.7790 4.7790 4.8030 4.8030 6.1319 6.1319 6.2374 6.2374 6.5001 6.5001 6.6047 6.6047 7.5912 7.5912 7.6120 7.6120 7.6680 7.6680 7.6910 7.6910 8.3069 8.3069 8.4328 8.4328 8.5338 8.5338 8.6043 8.6043 9.3816 9.3816 9.4083 9.4083 11.7481 11.7481 11.9460 11.9460 k = 0.4100 0.4100 0.2280 ( 15908 PWs) bands (ev): -69.8706 -69.8706 -69.8686 -69.8686 -39.6432 -39.6432 -39.6419 -39.6419 -38.4815 -38.4815 -38.4792 -38.4792 -38.3875 -38.3875 -38.3872 -38.3872 -19.4565 -19.4565 -19.4402 -19.4402 -15.9517 -15.9517 -15.9484 -15.9484 -6.1877 -6.1877 -6.1027 -6.1027 -4.3457 -4.3457 -4.2466 -4.2466 -4.1074 -4.1074 -4.0659 -4.0659 -0.2425 -0.2425 -0.1853 -0.1853 2.3391 2.3391 2.4112 2.4112 2.7357 2.7357 2.7839 2.7839 2.8943 2.8943 2.9870 2.9870 4.7962 4.7962 4.8272 4.8272 6.1258 6.1258 6.2465 6.2465 6.4829 6.4829 6.6112 6.6112 7.5900 7.5900 7.6150 7.6150 7.6826 7.6826 7.7083 7.7083 8.3107 8.3107 8.4627 8.4627 8.5323 8.5323 8.6189 8.6189 9.3819 9.3819 9.4142 9.4142 11.7277 11.7277 11.9265 11.9265 k = 0.4000 0.4000 0.2280 ( 15928 PWs) bands (ev): -69.8716 -69.8716 -69.8688 -69.8688 -39.6434 -39.6434 -39.6417 -39.6417 -38.4818 -38.4818 -38.4790 -38.4790 -38.3876 -38.3876 -38.3872 -38.3872 -19.4602 -19.4602 -19.4402 -19.4402 -15.9491 -15.9491 -15.9452 -15.9452 -6.1913 -6.1913 -6.0977 -6.0977 -4.3511 -4.3511 -4.2417 -4.2417 -4.1089 -4.1089 -4.0600 -4.0600 -0.2572 -0.2572 -0.1865 -0.1865 2.3352 2.3352 2.4198 2.4198 2.7211 2.7211 2.7739 2.7739 2.8844 2.8844 2.9920 2.9920 4.8144 4.8144 4.8544 4.8544 6.1191 6.1191 6.2555 6.2555 6.4647 6.4647 6.6182 6.6182 7.5873 7.5873 7.6160 7.6160 7.6983 7.6983 7.7260 7.7260 8.3088 8.3088 8.4956 8.4956 8.5276 8.5276 8.6306 8.6306 9.3820 9.3820 9.4234 9.4234 11.7102 11.7102 11.8991 11.8991 k = 0.3900 0.3900 0.2280 ( 15940 PWs) bands (ev): -69.8721 -69.8721 -69.8690 -69.8690 -39.6436 -39.6436 -39.6415 -39.6415 -38.4820 -38.4820 -38.4786 -38.4786 -38.3876 -38.3876 -38.3872 -38.3872 -19.4643 -19.4643 -19.4402 -19.4402 -15.9462 -15.9462 -15.9416 -15.9416 -6.1946 -6.1946 -6.0929 -6.0929 -4.3564 -4.3564 -4.2368 -4.2368 -4.1105 -4.1105 -4.0538 -4.0538 -0.2735 -0.2735 -0.1881 -0.1881 2.3318 2.3318 2.4293 2.4293 2.7061 2.7061 2.7631 2.7631 2.8734 2.8734 2.9965 2.9965 4.8334 4.8334 4.8838 4.8838 6.1120 6.1120 6.2647 6.2647 6.4457 6.4457 6.6259 6.6259 7.5850 7.5850 7.6201 7.6201 7.7148 7.7148 7.7461 7.7461 8.3105 8.3105 8.5204 8.5204 8.5320 8.5320 8.6482 8.6482 9.3792 9.3792 9.4337 9.4337 11.6962 11.6962 11.8686 11.8686 k = 0.3800 0.3800 0.2280 ( 15926 PWs) bands (ev): -69.8718 -69.8718 -69.8685 -69.8685 -39.6437 -39.6437 -39.6413 -39.6413 -38.4823 -38.4823 -38.4783 -38.4783 -38.3877 -38.3877 -38.3872 -38.3872 -19.4686 -19.4686 -19.4403 -19.4403 -15.9431 -15.9431 -15.9378 -15.9378 -6.1978 -6.1978 -6.0881 -6.0881 -4.3615 -4.3615 -4.2320 -4.2320 -4.1121 -4.1121 -4.0474 -4.0474 -0.2915 -0.2915 -0.1899 -0.1899 2.3292 2.3292 2.4397 2.4397 2.6907 2.6907 2.7516 2.7516 2.8615 2.8615 3.0007 3.0007 4.8534 4.8534 4.9161 4.9161 6.1044 6.1044 6.2742 6.2742 6.4261 6.4261 6.6350 6.6350 7.5844 7.5844 7.6284 7.6284 7.7365 7.7365 7.7663 7.7663 8.3151 8.3151 8.5191 8.5191 8.5711 8.5711 8.6690 8.6690 9.3789 9.3789 9.4465 9.4465 11.6858 11.6858 11.8370 11.8370 k = 0.3700 0.3700 0.2280 ( 15914 PWs) bands (ev): -69.8716 -69.8716 -69.8679 -69.8679 -39.6439 -39.6439 -39.6411 -39.6411 -38.4826 -38.4826 -38.4779 -38.4779 -38.3878 -38.3878 -38.3872 -38.3872 -19.4733 -19.4733 -19.4403 -19.4403 -15.9397 -15.9397 -15.9337 -15.9337 -6.2007 -6.2007 -6.0834 -6.0834 -4.3663 -4.3663 -4.2273 -4.2273 -4.1136 -4.1136 -4.0407 -4.0407 -0.3111 -0.3111 -0.1920 -0.1920 2.3273 2.3273 2.4509 2.4509 2.6751 2.6751 2.7396 2.7396 2.8485 2.8485 3.0043 3.0043 4.8734 4.8734 4.9510 4.9510 6.0962 6.0962 6.2837 6.2837 6.4065 6.4065 6.6444 6.6444 7.5809 7.5809 7.6357 7.6357 7.7586 7.7586 7.7889 7.7889 8.3230 8.3230 8.5164 8.5164 8.6122 8.6122 8.6919 8.6919 9.3793 9.3793 9.4621 9.4621 11.6787 11.6787 11.8037 11.8037 k = 0.3600 0.3600 0.2280 ( 15910 PWs) bands (ev): -69.8716 -69.8716 -69.8676 -69.8676 -39.6441 -39.6441 -39.6409 -39.6409 -38.4829 -38.4829 -38.4774 -38.4774 -38.3879 -38.3879 -38.3872 -38.3872 -19.4782 -19.4782 -19.4404 -19.4404 -15.9362 -15.9362 -15.9294 -15.9294 -6.2033 -6.2033 -6.0788 -6.0788 -4.3707 -4.3707 -4.2227 -4.2227 -4.1150 -4.1150 -4.0339 -4.0339 -0.3322 -0.3322 -0.1945 -0.1945 2.3263 2.3263 2.4628 2.4628 2.6593 2.6593 2.7270 2.7270 2.8346 2.8346 3.0074 3.0074 4.8936 4.8936 4.9886 4.9886 6.0873 6.0873 6.2927 6.2927 6.3870 6.3870 6.6544 6.6544 7.5766 7.5766 7.6456 7.6456 7.7807 7.7807 7.8115 7.8115 8.3276 8.3276 8.5131 8.5131 8.6552 8.6552 8.7148 8.7148 9.3798 9.3798 9.4781 9.4781 11.6748 11.6748 11.7710 11.7710 k = 0.3500 0.3500 0.2280 ( 15926 PWs) bands (ev): -69.8717 -69.8717 -69.8686 -69.8686 -39.6443 -39.6443 -39.6406 -39.6406 -38.4832 -38.4832 -38.4770 -38.4770 -38.3880 -38.3880 -38.3872 -38.3872 -19.4833 -19.4833 -19.4404 -19.4404 -15.9324 -15.9324 -15.9249 -15.9249 -6.2058 -6.2058 -6.0744 -6.0744 -4.3749 -4.3749 -4.2182 -4.2182 -4.1162 -4.1162 -4.0270 -4.0270 -0.3548 -0.3548 -0.1973 -0.1973 2.3263 2.3263 2.4755 2.4755 2.6433 2.6433 2.7141 2.7141 2.8199 2.8199 3.0100 3.0100 4.9135 4.9135 5.0285 5.0285 6.0777 6.0777 6.3007 6.3007 6.3678 6.3678 6.6643 6.6643 7.5702 7.5702 7.6573 7.6573 7.8016 7.8016 7.8331 7.8331 8.3323 8.3323 8.5100 8.5100 8.6976 8.6976 8.7345 8.7345 9.3786 9.3786 9.4932 9.4932 11.6728 11.6728 11.7395 11.7395 k = 0.3400 0.3400 0.2280 ( 15944 PWs) bands (ev): -69.8726 -69.8726 -69.8688 -69.8688 -39.6445 -39.6445 -39.6404 -39.6404 -38.4836 -38.4836 -38.4766 -38.4766 -38.3881 -38.3881 -38.3872 -38.3872 -19.4887 -19.4887 -19.4405 -19.4405 -15.9285 -15.9285 -15.9202 -15.9202 -6.2079 -6.2079 -6.0701 -6.0701 -4.3786 -4.3786 -4.2140 -4.2140 -4.1171 -4.1171 -4.0201 -4.0201 -0.3788 -0.3788 -0.2006 -0.2006 2.3271 2.3271 2.4889 2.4889 2.6273 2.6273 2.7009 2.7009 2.8042 2.8042 3.0121 3.0121 4.9332 4.9332 5.0709 5.0709 6.0674 6.0674 6.3068 6.3068 6.3505 6.3505 6.6755 6.6755 7.5633 7.5633 7.6674 7.6674 7.8258 7.8258 7.8561 7.8561 8.3334 8.3334 8.5054 8.5054 8.7438 8.7438 8.7554 8.7554 9.3770 9.3770 9.5101 9.5101 11.6680 11.6680 11.7128 11.7128 k = 0.3300 0.3300 0.2280 ( 15928 PWs) bands (ev): -69.8726 -69.8726 -69.8678 -69.8678 -39.6448 -39.6448 -39.6402 -39.6402 -38.4839 -38.4839 -38.4761 -38.4761 -38.3882 -38.3882 -38.3872 -38.3872 -19.4943 -19.4943 -19.4405 -19.4405 -15.9243 -15.9243 -15.9153 -15.9153 -6.2098 -6.2098 -6.0660 -6.0660 -4.3820 -4.3820 -4.2100 -4.2100 -4.1177 -4.1177 -4.0132 -4.0132 -0.4041 -0.4041 -0.2042 -0.2042 2.3288 2.3288 2.5027 2.5027 2.6113 2.6113 2.6876 2.6876 2.7879 2.7879 3.0136 3.0136 4.9531 4.9531 5.1160 5.1160 6.0569 6.0569 6.3083 6.3083 6.3393 6.3393 6.6882 6.6882 7.5578 7.5578 7.6825 7.6825 7.8518 7.8518 7.8816 7.8816 8.3401 8.3401 8.4986 8.4986 8.7798 8.7798 8.7973 8.7973 9.3796 9.3796 9.5318 9.5318 11.6471 11.6471 11.7057 11.7057 k = 0.3200 0.3200 0.2280 ( 15934 PWs) bands (ev): -69.8730 -69.8730 -69.8677 -69.8677 -39.6450 -39.6450 -39.6399 -39.6399 -38.4843 -38.4843 -38.4757 -38.4757 -38.3883 -38.3883 -38.3872 -38.3872 -19.5001 -19.5001 -19.4406 -19.4406 -15.9201 -15.9201 -15.9103 -15.9103 -6.2114 -6.2114 -6.0621 -6.0621 -4.3849 -4.3849 -4.2063 -4.2063 -4.1179 -4.1179 -4.0064 -4.0064 -0.4305 -0.4305 -0.2082 -0.2082 2.3312 2.3312 2.5170 2.5170 2.5953 2.5953 2.6743 2.6743 2.7708 2.7708 3.0145 3.0145 4.9721 4.9721 5.1631 5.1631 6.0457 6.0457 6.2987 6.2987 6.3389 6.3389 6.7005 6.7005 7.5490 7.5490 7.6973 7.6973 7.8776 7.8776 7.9054 7.9054 8.3468 8.3468 8.4946 8.4946 8.8069 8.8069 8.8463 8.8463 9.3786 9.3786 9.5503 9.5503 11.6110 11.6110 11.7138 11.7138 k = 0.3100 0.3100 0.2280 ( 15930 PWs) bands (ev): -69.8731 -69.8731 -69.8674 -69.8674 -39.6452 -39.6452 -39.6396 -39.6396 -38.4847 -38.4847 -38.4752 -38.4752 -38.3884 -38.3884 -38.3871 -38.3871 -19.5060 -19.5060 -19.4407 -19.4407 -15.9157 -15.9157 -15.9051 -15.9051 -6.2127 -6.2127 -6.0583 -6.0583 -4.3874 -4.3874 -4.2031 -4.2031 -4.1175 -4.1175 -3.9997 -3.9997 -0.4580 -0.4580 -0.2126 -0.2126 2.3343 2.3343 2.5313 2.5313 2.5795 2.5795 2.6613 2.6613 2.7531 2.7531 3.0150 3.0150 4.9908 4.9908 5.2122 5.2122 6.0342 6.0342 6.2839 6.2839 6.3446 6.3446 6.7133 6.7133 7.5405 7.5405 7.7153 7.7153 7.9053 7.9053 7.9303 7.9303 8.3552 8.3552 8.4910 8.4910 8.8354 8.8354 8.8971 8.8971 9.3761 9.3761 9.5707 9.5707 11.5684 11.5684 11.7288 11.7288 k = 0.3000 0.3000 0.2280 ( 15932 PWs) bands (ev): -69.8735 -69.8735 -69.8672 -69.8672 -39.6455 -39.6455 -39.6393 -39.6393 -38.4851 -38.4851 -38.4747 -38.4747 -38.3885 -38.3885 -38.3871 -38.3871 -19.5120 -19.5120 -19.4407 -19.4407 -15.9112 -15.9112 -15.8998 -15.8998 -6.2137 -6.2137 -6.0548 -6.0548 -4.3894 -4.3894 -4.2004 -4.2004 -4.1166 -4.1166 -3.9932 -3.9932 -0.4863 -0.4863 -0.2173 -0.2173 2.3379 2.3379 2.5449 2.5449 2.5641 2.5641 2.6490 2.6490 2.7349 2.7349 3.0149 3.0149 5.0086 5.0086 5.2636 5.2636 6.0225 6.0225 6.2684 6.2684 6.3516 6.3516 6.7267 6.7267 7.5291 7.5291 7.7338 7.7338 7.9336 7.9336 7.9567 7.9567 8.3622 8.3622 8.4872 8.4872 8.8637 8.8637 8.9483 8.9483 9.3752 9.3752 9.5905 9.5905 11.5204 11.5204 11.7482 11.7482 k = 0.2900 0.2900 0.2280 ( 15922 PWs) bands (ev): -69.8729 -69.8729 -69.8671 -69.8671 -39.6457 -39.6457 -39.6390 -39.6390 -38.4855 -38.4855 -38.4741 -38.4741 -38.3886 -38.3886 -38.3871 -38.3871 -19.5182 -19.5182 -19.4408 -19.4408 -15.9066 -15.9066 -15.8945 -15.8945 -6.2145 -6.2145 -6.0515 -6.0515 -4.3910 -4.3910 -4.1981 -4.1981 -4.1150 -4.1150 -3.9870 -3.9870 -0.5154 -0.5154 -0.2224 -0.2224 2.3419 2.3419 2.5466 2.5466 2.5595 2.5595 2.6385 2.6385 2.7164 2.7164 3.0143 3.0143 5.0262 5.0262 5.3171 5.3171 6.0107 6.0107 6.2533 6.2533 6.3589 6.3589 6.7398 6.7398 7.5199 7.5199 7.7570 7.7570 7.9605 7.9605 7.9816 7.9816 8.3742 8.3742 8.4867 8.4867 8.8928 8.8928 8.9989 8.9989 9.3734 9.3734 9.6121 9.6121 11.4695 11.4695 11.7712 11.7712 k = 0.2800 0.2800 0.2280 ( 15920 PWs) bands (ev): -69.8729 -69.8729 -69.8670 -69.8670 -39.6460 -39.6460 -39.6388 -39.6388 -38.4859 -38.4859 -38.4736 -38.4736 -38.3887 -38.3887 -38.3870 -38.3870 -19.5244 -19.5244 -19.4409 -19.4409 -15.9019 -15.9019 -15.8891 -15.8891 -6.2149 -6.2149 -6.0484 -6.0484 -4.3920 -4.3920 -4.1964 -4.1964 -4.1129 -4.1129 -3.9811 -3.9811 -0.5450 -0.5450 -0.2279 -0.2279 2.3462 2.3462 2.5319 2.5319 2.5680 2.5680 2.6317 2.6317 2.6975 2.6975 3.0133 3.0133 5.0430 5.0430 5.3724 5.3724 5.9988 5.9988 6.2390 6.2390 6.3664 6.3664 6.7520 6.7520 7.5085 7.5085 7.7790 7.7790 7.9888 7.9888 8.0062 8.0062 8.3847 8.3847 8.4871 8.4871 8.9242 8.9242 9.0458 9.0458 9.3738 9.3738 9.6337 9.6337 11.4159 11.4159 11.7967 11.7967 k = 0.2700 0.2700 0.2280 ( 15920 PWs) bands (ev): -69.8727 -69.8727 -69.8672 -69.8672 -39.6463 -39.6463 -39.6385 -39.6385 -38.4863 -38.4863 -38.4731 -38.4731 -38.3888 -38.3888 -38.3870 -38.3870 -19.5307 -19.5307 -19.4409 -19.4409 -15.8971 -15.8971 -15.8836 -15.8836 -6.2150 -6.2150 -6.0455 -6.0455 -4.3925 -4.3925 -4.1951 -4.1951 -4.1101 -4.1101 -3.9755 -3.9755 -0.5750 -0.5750 -0.2337 -0.2337 2.3505 2.3505 2.5169 2.5169 2.5702 2.5702 2.6321 2.6321 2.6785 2.6785 3.0117 3.0117 5.0592 5.0592 5.4293 5.4293 5.9873 5.9873 6.2261 6.2261 6.3731 6.3731 6.7658 6.7658 7.4991 7.4991 7.8038 7.8038 8.0132 8.0132 8.0306 8.0306 8.3952 8.3952 8.4852 8.4852 8.9544 8.9544 9.0942 9.0942 9.3713 9.3713 9.6559 9.6559 11.3628 11.3628 11.8245 11.8245 k = 0.2600 0.2600 0.2280 ( 15908 PWs) bands (ev): -69.8727 -69.8727 -69.8665 -69.8665 -39.6465 -39.6465 -39.6382 -39.6382 -38.4868 -38.4868 -38.4725 -38.4725 -38.3889 -38.3889 -38.3870 -38.3870 -19.5370 -19.5370 -19.4410 -19.4410 -15.8923 -15.8923 -15.8782 -15.8782 -6.2149 -6.2149 -6.0428 -6.0428 -4.3925 -4.3925 -4.1943 -4.1943 -4.1067 -4.1067 -3.9704 -3.9704 -0.6053 -0.6053 -0.2399 -0.2399 2.3548 2.3548 2.5021 2.5021 2.5649 2.5649 2.6401 2.6401 2.6597 2.6597 3.0098 3.0098 5.0746 5.0746 5.4877 5.4877 5.9763 5.9763 6.2148 6.2148 6.3804 6.3804 6.7797 6.7797 7.4868 7.4868 7.8275 7.8275 8.0392 8.0392 8.0586 8.0586 8.4108 8.4108 8.4844 8.4844 8.9887 8.9887 9.1391 9.1391 9.3707 9.3707 9.6793 9.6793 11.3120 11.3120 11.8536 11.8536 k = 0.2500 0.2500 0.2280 ( 15904 PWs) bands (ev): -69.8725 -69.8725 -69.8664 -69.8664 -39.6468 -39.6468 -39.6379 -39.6379 -38.4872 -38.4872 -38.4720 -38.4720 -38.3890 -38.3890 -38.3870 -38.3870 -19.5433 -19.5433 -19.4411 -19.4411 -15.8875 -15.8875 -15.8727 -15.8727 -6.2145 -6.2145 -6.0404 -6.0404 -4.3920 -4.3920 -4.1938 -4.1938 -4.1028 -4.1028 -3.9657 -3.9657 -0.6356 -0.6356 -0.2462 -0.2462 2.3589 2.3589 2.4875 2.4875 2.5550 2.5550 2.6402 2.6402 2.6537 2.6537 3.0074 3.0074 5.0892 5.0892 5.5471 5.5471 5.9660 5.9660 6.2051 6.2051 6.3870 6.3870 6.7931 6.7931 7.4735 7.4735 7.8557 7.8557 8.0606 8.0606 8.0850 8.0850 8.4234 8.4234 8.4868 8.4868 9.0226 9.0226 9.1802 9.1802 9.3690 9.3690 9.7028 9.7028 11.2673 11.2673 11.8826 11.8826 k = 0.2400 0.2400 0.2280 ( 15912 PWs) bands (ev): -69.8728 -69.8728 -69.8666 -69.8666 -39.6471 -39.6471 -39.6376 -39.6376 -38.4876 -38.4876 -38.4715 -38.4715 -38.3891 -38.3891 -38.3869 -38.3869 -19.5496 -19.5496 -19.4412 -19.4412 -15.8826 -15.8826 -15.8672 -15.8672 -6.2138 -6.2138 -6.0383 -6.0383 -4.3909 -4.3909 -4.1935 -4.1935 -4.0985 -4.0985 -3.9615 -3.9615 -0.6659 -0.6659 -0.2528 -0.2528 2.3625 2.3625 2.4733 2.4733 2.5427 2.5427 2.6220 2.6220 2.6685 2.6685 3.0047 3.0047 5.1027 5.1027 5.6069 5.6069 5.9569 5.9569 6.1970 6.1970 6.3932 6.3932 6.8062 6.8062 7.4604 7.4604 7.8828 7.8828 8.0797 8.0797 8.1100 8.1100 8.4345 8.4345 8.4890 8.4890 9.0569 9.0569 9.2156 9.2156 9.3666 9.3666 9.7264 9.7264 11.2296 11.2296 11.9104 11.9104 k = 0.2300 0.2300 0.2280 ( 15924 PWs) bands (ev): -69.8734 -69.8734 -69.8667 -69.8667 -39.6473 -39.6473 -39.6373 -39.6373 -38.4881 -38.4881 -38.4710 -38.4710 -38.3891 -38.3891 -38.3869 -38.3869 -19.5559 -19.5559 -19.4412 -19.4412 -15.8778 -15.8778 -15.8618 -15.8618 -6.2128 -6.2128 -6.0364 -6.0364 -4.3894 -4.3894 -4.1934 -4.1934 -4.0939 -4.0939 -3.9579 -3.9579 -0.6959 -0.6959 -0.2596 -0.2596 2.3657 2.3657 2.4595 2.4595 2.5293 2.5293 2.6042 2.6042 2.6846 2.6846 3.0016 3.0016 5.1152 5.1152 5.6664 5.6664 5.9499 5.9499 6.1908 6.1908 6.3990 6.3990 6.8194 6.8194 7.4450 7.4450 7.9105 7.9105 8.0962 8.0962 8.1338 8.1338 8.4465 8.4465 8.4928 8.4928 9.0922 9.0922 9.2451 9.2451 9.3646 9.3646 9.7508 9.7508 11.2013 11.2013 11.9349 11.9349 k = 0.2200 0.2200 0.2280 ( 15934 PWs) bands (ev): -69.8736 -69.8736 -69.8672 -69.8672 -39.6476 -39.6476 -39.6370 -39.6370 -38.4885 -38.4885 -38.4704 -38.4704 -38.3892 -38.3892 -38.3869 -38.3869 -19.5620 -19.5620 -19.4413 -19.4413 -15.8730 -15.8730 -15.8565 -15.8565 -6.2115 -6.2115 -6.0348 -6.0348 -4.3874 -4.3874 -4.1934 -4.1934 -4.0891 -4.0891 -3.9548 -3.9548 -0.7255 -0.7255 -0.2666 -0.2666 2.3682 2.3682 2.4462 2.4462 2.5152 2.5152 2.5873 2.5873 2.7010 2.7010 2.9982 2.9982 5.1266 5.1266 5.7234 5.7234 5.9466 5.9466 6.1869 6.1869 6.4050 6.4050 6.8318 6.8318 7.4276 7.4276 7.9410 7.9410 8.1112 8.1112 8.1554 8.1554 8.4588 8.4588 8.5020 8.5020 9.1294 9.1294 9.2672 9.2672 9.3612 9.3612 9.7766 9.7766 11.1841 11.1841 11.9539 11.9539 k = 0.2100 0.2100 0.2280 ( 15912 PWs) bands (ev): -69.8730 -69.8730 -69.8664 -69.8664 -39.6479 -39.6479 -39.6367 -39.6367 -38.4890 -38.4890 -38.4699 -38.4699 -38.3893 -38.3893 -38.3868 -38.3868 -19.5681 -19.5681 -19.4414 -19.4414 -15.8682 -15.8682 -15.8513 -15.8513 -6.2100 -6.2100 -6.0334 -6.0334 -4.3850 -4.3850 -4.1934 -4.1934 -4.0840 -4.0840 -3.9524 -3.9524 -0.7546 -0.7546 -0.2736 -0.2736 2.3699 2.3699 2.4333 2.4333 2.5005 2.5005 2.5713 2.5713 2.7174 2.7174 2.9946 2.9946 5.1371 5.1371 5.7744 5.7744 5.9514 5.9514 6.1860 6.1860 6.4110 6.4110 6.8457 6.8457 7.4146 7.4146 7.9750 7.9750 8.1265 8.1265 8.1813 8.1813 8.4714 8.4714 8.5153 8.5153 9.1676 9.1676 9.2852 9.2852 9.3606 9.3606 9.8048 9.8048 11.1792 11.1792 11.9656 11.9656 k = 0.2000 0.2000 0.2280 ( 15904 PWs) bands (ev): -69.8726 -69.8726 -69.8663 -69.8663 -39.6481 -39.6481 -39.6364 -39.6364 -38.4894 -38.4894 -38.4694 -38.4694 -38.3894 -38.3894 -38.3868 -38.3868 -19.5741 -19.5741 -19.4415 -19.4415 -15.8636 -15.8636 -15.8461 -15.8461 -6.2083 -6.2083 -6.0322 -6.0322 -4.3822 -4.3822 -4.1932 -4.1932 -4.0789 -4.0789 -3.9507 -3.9507 -0.7830 -0.7830 -0.2807 -0.2807 2.3707 2.3707 2.4209 2.4209 2.4855 2.4855 2.5566 2.5566 2.7337 2.7337 2.9908 2.9908 5.1464 5.1464 5.8123 5.8123 5.9701 5.9701 6.1877 6.1877 6.4166 6.4166 6.8595 6.8595 7.4014 7.4014 8.0117 8.0117 8.1398 8.1398 8.2005 8.2005 8.4818 8.4818 8.5281 8.5281 9.2050 9.2050 9.2965 9.2965 9.3557 9.3557 9.8342 9.8342 11.1870 11.1870 11.9684 11.9684 k = 0.1900 0.1900 0.2280 ( 15896 PWs) bands (ev): -69.8722 -69.8722 -69.8662 -69.8662 -39.6484 -39.6484 -39.6361 -39.6361 -38.4898 -38.4898 -38.4689 -38.4689 -38.3895 -38.3895 -38.3867 -38.3867 -19.5799 -19.5799 -19.4416 -19.4416 -15.8590 -15.8590 -15.8411 -15.8411 -6.2063 -6.2063 -6.0313 -6.0313 -4.3790 -4.3790 -4.1928 -4.1928 -4.0738 -4.0738 -3.9497 -3.9497 -0.8106 -0.8106 -0.2878 -0.2878 2.3703 2.3703 2.4091 2.4091 2.4703 2.4703 2.5433 2.5433 2.7496 2.7496 2.9868 2.9868 5.1543 5.1543 5.8326 5.8326 6.0071 6.0071 6.1925 6.1925 6.4221 6.4221 6.8728 6.8728 7.3895 7.3895 8.0457 8.0457 8.1522 8.1522 8.2159 8.2159 8.4937 8.4937 8.5444 8.5444 9.2392 9.2392 9.3028 9.3028 9.3527 9.3527 9.8649 9.8649 11.2069 11.2069 11.9575 11.9575 k = 0.1800 0.1800 0.2280 ( 15904 PWs) bands (ev): -69.8723 -69.8723 -69.8667 -69.8667 -39.6486 -39.6486 -39.6358 -39.6358 -38.4902 -38.4902 -38.4684 -38.4684 -38.3896 -38.3896 -38.3867 -38.3867 -19.5856 -19.5856 -19.4416 -19.4416 -15.8545 -15.8545 -15.8363 -15.8363 -6.2041 -6.2041 -6.0307 -6.0307 -4.3755 -4.3755 -4.1922 -4.1922 -4.0687 -4.0687 -3.9494 -3.9494 -0.8374 -0.8374 -0.2949 -0.2949 2.3684 2.3684 2.3980 2.3980 2.4553 2.4553 2.5312 2.5312 2.7650 2.7650 2.9828 2.9828 5.1605 5.1605 5.8390 5.8390 6.0568 6.0568 6.2003 6.2003 6.4261 6.4261 6.8859 6.8859 7.3745 7.3745 8.0796 8.0796 8.1618 8.1618 8.2297 8.2297 8.5073 8.5073 8.5609 8.5609 9.2582 9.2582 9.3146 9.3146 9.3483 9.3483 9.8949 9.8949 11.2387 11.2387 11.8987 11.8987 k = 0.1700 0.1700 0.2280 ( 15900 PWs) bands (ev): -69.8723 -69.8723 -69.8664 -69.8664 -39.6489 -39.6489 -39.6356 -39.6356 -38.4906 -38.4906 -38.4679 -38.4679 -38.3896 -38.3896 -38.3866 -38.3866 -19.5911 -19.5911 -19.4417 -19.4417 -15.8501 -15.8501 -15.8315 -15.8315 -6.2017 -6.2017 -6.0303 -6.0303 -4.3717 -4.3717 -4.1912 -4.1912 -4.0638 -4.0638 -3.9498 -3.9498 -0.8631 -0.8631 -0.3019 -0.3019 2.3649 2.3649 2.3876 2.3876 2.4409 2.4409 2.5205 2.5205 2.7799 2.7799 2.9787 2.9787 5.1656 5.1656 5.8388 5.8388 6.1105 6.1105 6.2141 6.2141 6.4323 6.4323 6.8993 6.8993 7.3584 7.3584 8.1134 8.1134 8.1714 8.1714 8.2398 8.2398 8.5236 8.5236 8.5787 8.5787 9.2555 9.2555 9.3365 9.3365 9.3563 9.3563 9.9265 9.9265 11.2816 11.2816 11.8173 11.8173 k = 0.1600 0.1600 0.2280 ( 15898 PWs) bands (ev): -69.8720 -69.8720 -69.8665 -69.8665 -39.6491 -39.6491 -39.6353 -39.6353 -38.4910 -38.4910 -38.4675 -38.4675 -38.3897 -38.3897 -38.3866 -38.3866 -19.5963 -19.5963 -19.4418 -19.4418 -15.8459 -15.8459 -15.8270 -15.8270 -6.1992 -6.1992 -6.0301 -6.0301 -4.3678 -4.3678 -4.1898 -4.1898 -4.0589 -4.0589 -3.9509 -3.9509 -0.8877 -0.8877 -0.3088 -0.3088 2.3592 2.3592 2.3781 2.3781 2.4276 2.4276 2.5110 2.5110 2.7940 2.7940 2.9746 2.9746 5.1694 5.1694 5.8357 5.8357 6.1579 6.1579 6.2397 6.2397 6.4369 6.4369 6.9131 6.9131 7.3446 7.3446 8.1478 8.1478 8.1816 8.1816 8.2461 8.2461 8.5414 8.5414 8.5959 8.5959 9.2400 9.2400 9.3339 9.3339 9.3921 9.3921 9.9598 9.9598 11.3341 11.3341 11.7316 11.7316 k = 0.1500 0.1500 0.2280 ( 15886 PWs) bands (ev): -69.8716 -69.8716 -69.8662 -69.8662 -39.6493 -39.6493 -39.6351 -39.6351 -38.4914 -38.4914 -38.4671 -38.4671 -38.3898 -38.3898 -38.3865 -38.3865 -19.6014 -19.6014 -19.4419 -19.4419 -15.8418 -15.8418 -15.8227 -15.8227 -6.1966 -6.1966 -6.0301 -6.0301 -4.3637 -4.3637 -4.1879 -4.1879 -4.0542 -4.0542 -3.9528 -3.9528 -0.9111 -0.9111 -0.3155 -0.3155 2.3515 2.3515 2.3692 2.3692 2.4160 2.4160 2.5027 2.5027 2.8074 2.8074 2.9707 2.9707 5.1718 5.1718 5.8315 5.8315 6.1904 6.1904 6.2835 6.2835 6.4424 6.4424 6.9273 6.9273 7.3312 7.3312 8.1723 8.1723 8.2005 8.2005 8.2509 8.2509 8.5617 8.5617 8.6146 8.6146 9.2182 9.2182 9.3294 9.3294 9.4360 9.4360 9.9944 9.9944 11.3943 11.3943 11.6448 11.6448 k = 0.1400 0.1400 0.2280 ( 15870 PWs) bands (ev): -69.8712 -69.8712 -69.8657 -69.8657 -39.6495 -39.6495 -39.6348 -39.6348 -38.4917 -38.4917 -38.4666 -38.4666 -38.3898 -38.3898 -38.3865 -38.3865 -19.6062 -19.6062 -19.4420 -19.4420 -15.8379 -15.8379 -15.8186 -15.8186 -6.1938 -6.1938 -6.0304 -6.0304 -4.3597 -4.3597 -4.1855 -4.1855 -4.0498 -4.0498 -3.9553 -3.9553 -0.9333 -0.9333 -0.3219 -0.3219 2.3421 2.3421 2.3604 2.3604 2.4063 2.4063 2.4953 2.4953 2.8199 2.8199 2.9669 2.9669 5.1732 5.1732 5.8271 5.8271 6.2121 6.2121 6.3391 6.3391 6.4487 6.4487 6.9422 6.9422 7.3196 7.3196 8.1820 8.1820 8.2344 8.2344 8.2546 8.2546 8.5821 8.5821 8.6312 8.6312 9.1928 9.1928 9.3240 9.3240 9.4824 9.4824 10.0301 10.0301 11.4594 11.4594 11.5580 11.5580 k = 0.1300 0.1300 0.2280 ( 15866 PWs) bands (ev): -69.8705 -69.8705 -69.8662 -69.8662 -39.6498 -39.6498 -39.6346 -39.6346 -38.4921 -38.4921 -38.4662 -38.4662 -38.3899 -38.3899 -38.3864 -38.3864 -19.6108 -19.6108 -19.4420 -19.4420 -15.8342 -15.8342 -15.8147 -15.8147 -6.1910 -6.1910 -6.0308 -6.0308 -4.3556 -4.3556 -4.1825 -4.1825 -4.0457 -4.0457 -3.9586 -3.9586 -0.9542 -0.9542 -0.3282 -0.3282 2.3314 2.3314 2.3517 2.3517 2.3985 2.3985 2.4888 2.4888 2.8314 2.8314 2.9633 2.9633 5.1735 5.1735 5.8224 5.8224 6.2294 6.2294 6.3960 6.3960 6.4566 6.4566 6.9570 6.9570 7.3075 7.3075 8.1877 8.1877 8.2509 8.2509 8.2736 8.2736 8.6021 8.6021 8.6504 8.6504 9.1631 9.1631 9.3145 9.3145 9.5292 9.5292 10.0656 10.0656 11.4644 11.4644 11.5331 11.5331 k = 0.1200 0.1200 0.2280 ( 15866 PWs) bands (ev): -69.8706 -69.8706 -69.8661 -69.8661 -39.6499 -39.6499 -39.6344 -39.6344 -38.4924 -38.4924 -38.4659 -38.4659 -38.3899 -38.3899 -38.3863 -38.3863 -19.6151 -19.6151 -19.4421 -19.4421 -15.8307 -15.8307 -15.8110 -15.8110 -6.1881 -6.1881 -6.0313 -6.0313 -4.3517 -4.3517 -4.1789 -4.1789 -4.0419 -4.0419 -3.9624 -3.9624 -0.9736 -0.9736 -0.3341 -0.3341 2.3201 2.3201 2.3433 2.3433 2.3920 2.3920 2.4832 2.4832 2.8419 2.8419 2.9601 2.9601 5.1727 5.1727 5.8179 5.8179 6.2454 6.2454 6.4380 6.4380 6.4814 6.4814 6.9723 6.9723 7.2936 7.2936 8.1891 8.1891 8.2487 8.2487 8.3105 8.3105 8.6213 8.6213 8.6673 8.6673 9.1312 9.1312 9.3058 9.3058 9.5795 9.5795 10.1014 10.1014 11.3776 11.3776 11.5996 11.5996 k = 0.1100 0.1100 0.2280 ( 15862 PWs) bands (ev): -69.8706 -69.8706 -69.8658 -69.8658 -39.6501 -39.6501 -39.6342 -39.6342 -38.4927 -38.4927 -38.4655 -38.4655 -38.3900 -38.3900 -38.3863 -38.3863 -19.6191 -19.6191 -19.4422 -19.4422 -15.8274 -15.8274 -15.8076 -15.8076 -6.1852 -6.1852 -6.0320 -6.0320 -4.3479 -4.3479 -4.1746 -4.1746 -4.0385 -4.0385 -3.9669 -3.9669 -0.9917 -0.9917 -0.3397 -0.3397 2.3083 2.3083 2.3355 2.3355 2.3867 2.3867 2.4782 2.4782 2.8513 2.8513 2.9573 2.9573 5.1708 5.1708 5.8136 5.8136 6.2607 6.2607 6.4533 6.4533 6.5320 6.5320 6.9881 6.9881 7.2832 7.2832 8.1883 8.1883 8.2445 8.2445 8.3473 8.3473 8.6398 8.6398 8.6845 8.6845 9.0975 9.0975 9.2988 9.2988 9.6320 9.6320 10.1372 10.1372 11.2895 11.2895 11.6579 11.6579 k = 0.1000 0.1000 0.2280 ( 15858 PWs) bands (ev): -69.8707 -69.8707 -69.8656 -69.8656 -39.6503 -39.6503 -39.6340 -39.6340 -38.4930 -38.4930 -38.4652 -38.4652 -38.3900 -38.3900 -38.3863 -38.3863 -19.6228 -19.6228 -19.4422 -19.4422 -15.8244 -15.8244 -15.8044 -15.8044 -6.1824 -6.1824 -6.0328 -6.0328 -4.3444 -4.3444 -4.1696 -4.1696 -4.0356 -4.0356 -3.9717 -3.9717 -1.0082 -1.0082 -0.3449 -0.3449 2.2966 2.2966 2.3283 2.3283 2.3820 2.3820 2.4739 2.4739 2.8596 2.8596 2.9550 2.9550 5.1685 5.1685 5.8098 5.8098 6.2757 6.2757 6.4624 6.4624 6.5868 6.5868 7.0049 7.0049 7.2714 7.2714 8.1870 8.1870 8.2388 8.2388 8.3852 8.3852 8.6566 8.6566 8.7008 8.7008 9.0640 9.0640 9.2899 9.2899 9.6872 9.6872 10.1729 10.1729 11.2020 11.2020 11.6557 11.6557 k = 0.0900 0.0900 0.2280 ( 15848 PWs) bands (ev): -69.8701 -69.8701 -69.8655 -69.8655 -39.6504 -39.6504 -39.6338 -39.6338 -38.4932 -38.4932 -38.4649 -38.4649 -38.3900 -38.3900 -38.3862 -38.3862 -19.6262 -19.6262 -19.4423 -19.4423 -15.8216 -15.8216 -15.8015 -15.8015 -6.1796 -6.1796 -6.0337 -6.0337 -4.3412 -4.3412 -4.1641 -4.1641 -4.0332 -4.0332 -3.9769 -3.9769 -1.0233 -1.0233 -0.3498 -0.3498 2.2852 2.2852 2.3218 2.3218 2.3779 2.3779 2.4701 2.4701 2.8666 2.8666 2.9532 2.9532 5.1660 5.1660 5.8064 5.8064 6.2894 6.2894 6.4687 6.4687 6.6396 6.6396 7.0226 7.0226 7.2623 7.2623 8.1861 8.1861 8.2341 8.2341 8.4222 8.4222 8.6749 8.6749 8.7191 8.7191 9.0303 9.0303 9.2808 9.2808 9.7421 9.7421 10.2076 10.2076 11.1142 11.1142 11.5970 11.5970 k = 0.0800 0.0800 0.2280 ( 15848 PWs) bands (ev): -69.8704 -69.8704 -69.8653 -69.8653 -39.6506 -39.6506 -39.6337 -39.6337 -38.4934 -38.4934 -38.4647 -38.4647 -38.3901 -38.3901 -38.3862 -38.3862 -19.6293 -19.6293 -19.4423 -19.4423 -15.8190 -15.8190 -15.7989 -15.7989 -6.1770 -6.1770 -6.0346 -6.0346 -4.3383 -4.3383 -4.1579 -4.1579 -4.0317 -4.0317 -3.9821 -3.9821 -1.0368 -1.0368 -0.3542 -0.3542 2.2746 2.2746 2.3161 2.3161 2.3742 2.3742 2.4668 2.4668 2.8724 2.8724 2.9520 2.9520 5.1631 5.1631 5.8038 5.8038 6.3020 6.3020 6.4758 6.4758 6.6879 6.6879 7.0412 7.0412 7.2526 7.2526 8.1830 8.1830 8.2281 8.2281 8.4576 8.4576 8.6878 8.6878 8.7337 8.7337 8.9966 8.9966 9.2710 9.2710 9.7999 9.7999 10.2408 10.2408 11.0278 11.0278 11.5366 11.5366 k = 0.0700 0.0700 0.2280 ( 15840 PWs) bands (ev): -69.8700 -69.8700 -69.8652 -69.8652 -39.6507 -39.6507 -39.6336 -39.6336 -38.4937 -38.4937 -38.4644 -38.4644 -38.3901 -38.3901 -38.3862 -38.3862 -19.6320 -19.6320 -19.4424 -19.4424 -15.8168 -15.8168 -15.7966 -15.7966 -6.1745 -6.1745 -6.0355 -6.0355 -4.3357 -4.3357 -4.1512 -4.1512 -4.0312 -4.0312 -3.9871 -3.9871 -1.0488 -1.0488 -0.3581 -0.3581 2.2648 2.2648 2.3110 2.3110 2.3710 2.3710 2.4640 2.4640 2.8770 2.8770 2.9514 2.9514 5.1601 5.1601 5.8010 5.8010 6.3133 6.3133 6.4828 6.4828 6.7310 6.7310 7.0609 7.0609 7.2452 7.2452 8.1791 8.1791 8.2228 8.2228 8.4930 8.4930 8.7025 8.7025 8.7498 8.7498 8.9641 8.9641 9.2614 9.2614 9.8595 9.8595 10.2719 10.2719 10.9428 10.9428 11.4807 11.4807 k = 0.0600 0.0600 0.2280 ( 15836 PWs) bands (ev): -69.8700 -69.8700 -69.8650 -69.8650 -39.6508 -39.6508 -39.6334 -39.6334 -38.4938 -38.4938 -38.4642 -38.4642 -38.3901 -38.3901 -38.3861 -38.3861 -19.6344 -19.6344 -19.4424 -19.4424 -15.8148 -15.8148 -15.7946 -15.7946 -6.1723 -6.1723 -6.0365 -6.0365 -4.3335 -4.3335 -4.1442 -4.1442 -4.0319 -4.0319 -3.9914 -3.9914 -1.0592 -1.0592 -0.3616 -0.3616 2.2561 2.2561 2.3067 2.3067 2.3682 2.3682 2.4616 2.4616 2.8805 2.8805 2.9513 2.9513 5.1574 5.1574 5.7983 5.7983 6.3233 6.3233 6.4902 6.4902 6.7676 6.7676 7.0812 7.0812 7.2373 7.2373 8.1744 8.1744 8.2187 8.2187 8.5278 8.5278 8.7124 8.7124 8.7611 8.7611 8.9336 8.9336 9.2531 9.2531 9.9212 9.9212 10.3008 10.3008 10.8599 10.8599 11.4311 11.4311 k = 0.0500 0.0500 0.2280 ( 15820 PWs) bands (ev): -69.8698 -69.8698 -69.8642 -69.8642 -39.6509 -39.6509 -39.6333 -39.6333 -38.4940 -38.4940 -38.4640 -38.4640 -38.3901 -38.3901 -38.3861 -38.3861 -19.6364 -19.6364 -19.4425 -19.4425 -15.8131 -15.8131 -15.7928 -15.7928 -6.1703 -6.1703 -6.0373 -6.0373 -4.3317 -4.3317 -4.1369 -4.1369 -4.0340 -4.0340 -3.9948 -3.9948 -1.0680 -1.0680 -0.3645 -0.3645 2.2485 2.2485 2.3030 2.3030 2.3658 2.3658 2.4596 2.4596 2.8830 2.8830 2.9515 2.9515 5.1550 5.1550 5.7976 5.7976 6.3321 6.3321 6.4977 6.4977 6.7981 6.7981 7.1016 7.1016 7.2302 7.2302 8.1689 8.1689 8.2162 8.2162 8.5614 8.5614 8.7225 8.7225 8.7715 8.7715 8.9053 8.9053 9.2485 9.2485 9.9849 9.9849 10.3257 10.3257 10.7798 10.7798 11.3877 11.3877 k = 0.0400 0.0400 0.2280 ( 15810 PWs) bands (ev): -69.8694 -69.8694 -69.8639 -69.8639 -39.6510 -39.6510 -39.6333 -39.6333 -38.4941 -38.4941 -38.4639 -38.4639 -38.3901 -38.3901 -38.3861 -38.3861 -19.6381 -19.6381 -19.4425 -19.4425 -15.8117 -15.8117 -15.7914 -15.7914 -6.1686 -6.1686 -6.0381 -6.0381 -4.3302 -4.3302 -4.1297 -4.1297 -4.0374 -4.0374 -3.9971 -3.9971 -1.0752 -1.0752 -0.3670 -0.3670 2.2422 2.2422 2.2999 2.2999 2.3638 2.3638 2.4580 2.4580 2.8848 2.8848 2.9521 2.9521 5.1526 5.1526 5.7966 5.7966 6.3387 6.3387 6.5039 6.5039 6.8222 6.8222 7.1208 7.1208 7.2250 7.2250 8.1633 8.1633 8.2136 8.2136 8.5936 8.5936 8.7325 8.7325 8.7789 8.7789 8.8801 8.8801 9.2413 9.2413 10.0493 10.0493 10.3450 10.3450 10.7030 10.7030 11.3519 11.3519 k = 0.0300 0.0300 0.2280 ( 15788 PWs) bands (ev): -69.8691 -69.8691 -69.8629 -69.8629 -39.6510 -39.6510 -39.6332 -39.6332 -38.4941 -38.4941 -38.4638 -38.4638 -38.3901 -38.3901 -38.3860 -38.3860 -19.6394 -19.6394 -19.4425 -19.4425 -15.8106 -15.8106 -15.7903 -15.7903 -6.1672 -6.1672 -6.0387 -6.0387 -4.3290 -4.3290 -4.1229 -4.1229 -4.0417 -4.0417 -3.9985 -3.9985 -1.0808 -1.0808 -0.3688 -0.3688 2.2372 2.2372 2.2976 2.2976 2.3622 2.3622 2.4567 2.4567 2.8859 2.8859 2.9526 2.9526 5.1507 5.1507 5.7973 5.7973 6.3445 6.3445 6.5094 6.5094 6.8403 6.8403 7.1376 7.1376 7.2196 7.2196 8.1600 8.1600 8.2118 8.2118 8.6248 8.6248 8.7429 8.7429 8.7809 8.7809 8.8607 8.8607 9.2383 9.2383 10.1139 10.1139 10.3587 10.3587 10.6316 10.6316 11.3242 11.3242 k = 0.0200 0.0200 0.2280 ( 15796 PWs) bands (ev): -69.8696 -69.8696 -69.8629 -69.8629 -39.6510 -39.6510 -39.6331 -39.6331 -38.4942 -38.4942 -38.4637 -38.4637 -38.3901 -38.3901 -38.3861 -38.3861 -19.6403 -19.6403 -19.4425 -19.4425 -15.8099 -15.8099 -15.7895 -15.7895 -6.1662 -6.1662 -6.0392 -6.0392 -4.3282 -4.3282 -4.1171 -4.1171 -4.0459 -4.0459 -3.9993 -3.9993 -1.0849 -1.0849 -0.3702 -0.3702 2.2336 2.2336 2.2959 2.2959 2.3611 2.3611 2.4558 2.4558 2.8866 2.8866 2.9532 2.9532 5.1492 5.1492 5.7961 5.7961 6.3483 6.3483 6.5136 6.5136 6.8523 6.8523 7.1499 7.1499 7.2173 7.2173 8.1541 8.1541 8.2102 8.2102 8.6508 8.6508 8.7445 8.7445 8.7721 8.7721 8.8446 8.8446 9.2352 9.2352 10.1775 10.1775 10.3617 10.3617 10.5703 10.5703 11.3032 11.3032 k = 0.0100 0.0100 0.2280 ( 15808 PWs) bands (ev): -69.8696 -69.8696 -69.8636 -69.8636 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4636 -38.4636 -38.3902 -38.3902 -38.3860 -38.3860 -19.6409 -19.6409 -19.4425 -19.4425 -15.8094 -15.8094 -15.7890 -15.7890 -6.1656 -6.1656 -6.0394 -6.0394 -4.3278 -4.3278 -4.1130 -4.1130 -4.0491 -4.0491 -3.9996 -3.9996 -1.0873 -1.0873 -0.3711 -0.3711 2.2315 2.2315 2.2949 2.2949 2.3604 2.3604 2.4553 2.4553 2.8870 2.8870 2.9535 2.9535 5.1484 5.1484 5.7943 5.7943 6.3492 6.3492 6.5148 6.5148 6.8593 6.8593 7.1576 7.1576 7.2153 7.2153 8.1501 8.1501 8.2104 8.2104 8.6718 8.6718 8.7495 8.7495 8.7583 8.7583 8.8374 8.8374 9.2318 9.2318 10.2350 10.2350 10.3478 10.3478 10.5264 10.5264 11.2906 11.2906 k = 0.0000 0.0000 0.2280 ( 15828 PWs) bands (ev): -69.8698 -69.8698 -69.8646 -69.8646 -39.6511 -39.6511 -39.6331 -39.6331 -38.4943 -38.4943 -38.4636 -38.4636 -38.3902 -38.3902 -38.3861 -38.3861 -19.6411 -19.6411 -19.4425 -19.4425 -15.8092 -15.8092 -15.7889 -15.7889 -6.1653 -6.1653 -6.0395 -6.0395 -4.3276 -4.3276 -4.1116 -4.1116 -4.0503 -4.0503 -3.9997 -3.9997 -1.0881 -1.0881 -0.3714 -0.3714 2.2307 2.2307 2.2946 2.2946 2.3602 2.3602 2.4551 2.4551 2.8871 2.8871 2.9537 2.9537 5.1480 5.1480 5.7934 5.7934 6.3473 6.3473 6.5124 6.5124 6.8617 6.8617 7.1603 7.1603 7.2148 7.2148 8.1504 8.1504 8.2092 8.2092 8.6814 8.6814 8.7475 8.7475 8.7509 8.7509 8.8357 8.8357 9.2294 9.2294 10.2638 10.2638 10.3309 10.3309 10.5074 10.5074 11.2868 11.2868 k = 0.0000 0.5000-0.0000 ( 15916 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2401 -4.2401 -4.2401 -4.2401 -4.1144 -4.1144 -4.1144 -4.1144 -0.3696 -0.3696 -0.3696 -0.3696 2.5057 2.5057 2.5057 2.5057 2.5856 2.5856 2.5856 2.5856 2.7409 2.7409 2.7409 2.7409 4.9860 4.9860 4.9860 4.9860 6.3545 6.3545 6.3545 6.3545 6.6810 6.6810 6.6810 6.6810 7.9261 7.9261 7.9261 7.9261 8.0650 8.0650 8.0650 8.0650 8.2274 8.2274 8.2274 8.2274 9.2158 9.2158 9.2158 9.2158 9.6349 9.6349 9.6349 9.6349 11.2008 11.2008 11.2008 11.2008 k = 0.0000 0.5000 0.0134 ( 15920 PWs) bands (ev): -69.8699 -69.8699 -69.8699 -69.8699 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3883 -38.3883 -38.3883 -38.3883 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2401 -4.2401 -4.2401 -4.2401 -4.1144 -4.1144 -4.1144 -4.1144 -0.3696 -0.3696 -0.3696 -0.3696 2.5057 2.5057 2.5057 2.5057 2.5856 2.5856 2.5856 2.5856 2.7409 2.7409 2.7409 2.7409 4.9857 4.9857 4.9857 4.9857 6.3548 6.3548 6.3548 6.3548 6.6808 6.6808 6.6808 6.6808 7.9257 7.9257 7.9257 7.9257 8.0647 8.0647 8.0647 8.0647 8.2269 8.2269 8.2269 8.2269 9.2167 9.2167 9.2167 9.2167 9.6345 9.6345 9.6345 9.6345 11.2018 11.2018 11.2018 11.2018 k = 0.0000 0.5000 0.0268 ( 15916 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2402 -4.2402 -4.2402 -4.2402 -4.1143 -4.1143 -4.1143 -4.1143 -0.3695 -0.3695 -0.3695 -0.3695 2.5057 2.5057 2.5057 2.5057 2.5856 2.5856 2.5856 2.5856 2.7407 2.7407 2.7407 2.7407 4.9849 4.9849 4.9849 4.9849 6.3561 6.3561 6.3561 6.3561 6.6809 6.6809 6.6809 6.6809 7.9261 7.9261 7.9261 7.9261 8.0645 8.0645 8.0645 8.0645 8.2271 8.2271 8.2271 8.2271 9.2198 9.2198 9.2198 9.2198 9.6346 9.6346 9.6346 9.6346 11.2047 11.2047 11.2047 11.2047 k = 0.0000 0.5000 0.0402 ( 15916 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3883 -38.3883 -38.3883 -38.3883 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2402 -4.2402 -4.2402 -4.2402 -4.1143 -4.1143 -4.1143 -4.1143 -0.3694 -0.3694 -0.3694 -0.3694 2.5057 2.5057 2.5057 2.5057 2.5856 2.5856 2.5856 2.5856 2.7404 2.7404 2.7404 2.7404 4.9835 4.9835 4.9835 4.9835 6.3573 6.3573 6.3573 6.3573 6.6812 6.6812 6.6812 6.6812 7.9264 7.9264 7.9264 7.9264 8.0656 8.0656 8.0656 8.0656 8.2252 8.2252 8.2252 8.2252 9.2238 9.2238 9.2238 9.2238 9.6352 9.6352 9.6352 9.6352 11.2101 11.2101 11.2101 11.2101 k = 0.0000 0.5000 0.0536 ( 15906 PWs) bands (ev): -69.8695 -69.8695 -69.8695 -69.8695 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2403 -4.2403 -4.2403 -4.2403 -4.1142 -4.1142 -4.1142 -4.1142 -0.3692 -0.3692 -0.3692 -0.3692 2.5057 2.5057 2.5057 2.5057 2.5856 2.5856 2.5856 2.5856 2.7401 2.7401 2.7401 2.7401 4.9817 4.9817 4.9817 4.9817 6.3594 6.3594 6.3594 6.3594 6.6817 6.6817 6.6817 6.6817 7.9269 7.9269 7.9269 7.9269 8.0674 8.0674 8.0674 8.0674 8.2252 8.2252 8.2252 8.2252 9.2299 9.2299 9.2299 9.2299 9.6361 9.6361 9.6361 9.6361 11.2177 11.2177 11.2177 11.2177 k = 0.0000 0.5000 0.0671 ( 15894 PWs) bands (ev): -69.8692 -69.8692 -69.8692 -69.8692 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2404 -4.2404 -4.2404 -4.2404 -4.1141 -4.1141 -4.1141 -4.1141 -0.3690 -0.3690 -0.3690 -0.3690 2.5057 2.5057 2.5057 2.5057 2.5855 2.5855 2.5855 2.5855 2.7396 2.7396 2.7396 2.7396 4.9795 4.9795 4.9795 4.9795 6.3619 6.3619 6.3619 6.3619 6.6822 6.6822 6.6822 6.6822 7.9273 7.9273 7.9273 7.9273 8.0693 8.0693 8.0693 8.0693 8.2260 8.2260 8.2260 8.2260 9.2373 9.2373 9.2373 9.2373 9.6371 9.6371 9.6371 9.6371 11.2273 11.2273 11.2273 11.2273 k = 0.0000 0.5000 0.0805 ( 15886 PWs) bands (ev): -69.8689 -69.8689 -69.8689 -69.8689 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2405 -4.2405 -4.2405 -4.2405 -4.1140 -4.1140 -4.1140 -4.1140 -0.3688 -0.3688 -0.3688 -0.3688 2.5058 2.5058 2.5058 2.5058 2.5855 2.5855 2.5855 2.5855 2.7391 2.7391 2.7391 2.7391 4.9770 4.9770 4.9770 4.9770 6.3645 6.3645 6.3645 6.3645 6.6827 6.6827 6.6827 6.6827 7.9281 7.9281 7.9281 7.9281 8.0705 8.0705 8.0705 8.0705 8.2268 8.2268 8.2268 8.2268 9.2450 9.2450 9.2450 9.2450 9.6381 9.6381 9.6381 9.6381 11.2386 11.2386 11.2386 11.2386 k = 0.0000 0.5000 0.0939 ( 15900 PWs) bands (ev): -69.8693 -69.8693 -69.8693 -69.8693 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2406 -4.2406 -4.2406 -4.2406 -4.1139 -4.1139 -4.1139 -4.1139 -0.3686 -0.3686 -0.3686 -0.3686 2.5058 2.5058 2.5058 2.5058 2.5855 2.5855 2.5855 2.5855 2.7386 2.7386 2.7386 2.7386 4.9741 4.9741 4.9741 4.9741 6.3670 6.3670 6.3670 6.3670 6.6826 6.6826 6.6826 6.6826 7.9272 7.9272 7.9272 7.9272 8.0698 8.0698 8.0698 8.0698 8.2244 8.2244 8.2244 8.2244 9.2527 9.2527 9.2527 9.2527 9.6382 9.6382 9.6382 9.6382 11.2515 11.2515 11.2515 11.2515 k = 0.0000 0.5000 0.1073 ( 15902 PWs) bands (ev): -69.8694 -69.8694 -69.8694 -69.8694 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2407 -4.2407 -4.2407 -4.2407 -4.1137 -4.1137 -4.1137 -4.1137 -0.3684 -0.3684 -0.3684 -0.3684 2.5058 2.5058 2.5058 2.5058 2.5855 2.5855 2.5855 2.5855 2.7380 2.7380 2.7380 2.7380 4.9711 4.9711 4.9711 4.9711 6.3699 6.3699 6.3699 6.3699 6.6827 6.6827 6.6827 6.6827 7.9265 7.9265 7.9265 7.9265 8.0703 8.0703 8.0703 8.0703 8.2243 8.2243 8.2243 8.2243 9.2615 9.2615 9.2615 9.2615 9.6386 9.6386 9.6386 9.6386 11.2663 11.2663 11.2663 11.2663 k = 0.0000 0.5000 0.1207 ( 15908 PWs) bands (ev): -69.8695 -69.8695 -69.8695 -69.8695 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2408 -4.2408 -4.2408 -4.2408 -4.1136 -4.1136 -4.1136 -4.1136 -0.3681 -0.3681 -0.3681 -0.3681 2.5058 2.5058 2.5058 2.5058 2.5855 2.5855 2.5855 2.5855 2.7374 2.7374 2.7374 2.7374 4.9681 4.9681 4.9681 4.9681 6.3725 6.3725 6.3725 6.3725 6.6829 6.6829 6.6829 6.6829 7.9262 7.9262 7.9262 7.9262 8.0710 8.0710 8.0710 8.0710 8.2220 8.2220 8.2220 8.2220 9.2702 9.2702 9.2702 9.2702 9.6393 9.6393 9.6393 9.6393 11.2826 11.2826 11.2826 11.2826 k = 0.0000 0.5000 0.1341 ( 15908 PWs) bands (ev): -69.8695 -69.8695 -69.8695 -69.8695 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2409 -4.2409 -4.2409 -4.2409 -4.1135 -4.1135 -4.1135 -4.1135 -0.3678 -0.3678 -0.3678 -0.3678 2.5058 2.5058 2.5058 2.5058 2.5855 2.5855 2.5855 2.5855 2.7368 2.7368 2.7368 2.7368 4.9652 4.9652 4.9652 4.9652 6.3753 6.3753 6.3753 6.3753 6.6829 6.6829 6.6829 6.6829 7.9258 7.9258 7.9258 7.9258 8.0720 8.0720 8.0720 8.0720 8.2224 8.2224 8.2224 8.2224 9.2790 9.2790 9.2790 9.2790 9.6396 9.6396 9.6396 9.6396 11.3002 11.3002 11.3002 11.3002 k = 0.0000 0.5000 0.1475 ( 15918 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3883 -38.3883 -38.3883 -38.3883 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2411 -4.2411 -4.2411 -4.2411 -4.1134 -4.1134 -4.1134 -4.1134 -0.3676 -0.3676 -0.3676 -0.3676 2.5058 2.5058 2.5058 2.5058 2.5855 2.5855 2.5855 2.5855 2.7362 2.7362 2.7362 2.7362 4.9624 4.9624 4.9624 4.9624 6.3779 6.3779 6.3779 6.3779 6.6825 6.6825 6.6825 6.6825 7.9242 7.9242 7.9242 7.9242 8.0712 8.0712 8.0712 8.0712 8.2227 8.2227 8.2227 8.2227 9.2873 9.2873 9.2873 9.2873 9.6390 9.6390 9.6390 9.6390 11.3179 11.3179 11.3179 11.3179 k = 0.0000 0.5000 0.1609 ( 15926 PWs) bands (ev): -69.8700 -69.8700 -69.8700 -69.8700 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3883 -38.3883 -38.3883 -38.3883 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2412 -4.2412 -4.2412 -4.2412 -4.1133 -4.1133 -4.1133 -4.1133 -0.3674 -0.3674 -0.3674 -0.3674 2.5058 2.5058 2.5058 2.5058 2.5855 2.5855 2.5855 2.5855 2.7357 2.7357 2.7357 2.7357 4.9599 4.9599 4.9599 4.9599 6.3801 6.3801 6.3801 6.3801 6.6824 6.6824 6.6824 6.6824 7.9235 7.9235 7.9235 7.9235 8.0717 8.0717 8.0717 8.0717 8.2211 8.2211 8.2211 8.2211 9.2949 9.2949 9.2949 9.2949 9.6390 9.6390 9.6390 9.6390 11.3360 11.3360 11.3360 11.3360 k = 0.0000 0.5000 0.1744 ( 15906 PWs) bands (ev): -69.8694 -69.8694 -69.8694 -69.8694 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2412 -4.2412 -4.2412 -4.2412 -4.1132 -4.1132 -4.1132 -4.1132 -0.3672 -0.3672 -0.3672 -0.3672 2.5058 2.5058 2.5058 2.5058 2.5855 2.5855 2.5855 2.5855 2.7353 2.7353 2.7353 2.7353 4.9578 4.9578 4.9578 4.9578 6.3824 6.3824 6.3824 6.3824 6.6838 6.6838 6.6838 6.6838 7.9253 7.9253 7.9253 7.9253 8.0733 8.0733 8.0733 8.0733 8.2226 8.2226 8.2226 8.2226 9.3023 9.3023 9.3023 9.3023 9.6416 9.6416 9.6416 9.6416 11.3532 11.3532 11.3532 11.3532 k = 0.0000 0.5000 0.1878 ( 15902 PWs) bands (ev): -69.8693 -69.8693 -69.8693 -69.8693 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2413 -4.2413 -4.2413 -4.2413 -4.1131 -4.1131 -4.1131 -4.1131 -0.3670 -0.3670 -0.3670 -0.3670 2.5058 2.5058 2.5058 2.5058 2.5855 2.5855 2.5855 2.5855 2.7349 2.7349 2.7349 2.7349 4.9561 4.9561 4.9561 4.9561 6.3842 6.3842 6.3842 6.3842 6.6842 6.6842 6.6842 6.6842 7.9260 7.9260 7.9260 7.9260 8.0749 8.0749 8.0749 8.0749 8.2210 8.2210 8.2210 8.2210 9.3084 9.3084 9.3084 9.3084 9.6424 9.6424 9.6424 9.6424 11.3685 11.3685 11.3685 11.3685 k = 0.0000 0.5000 0.2012 ( 15920 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3883 -38.3883 -38.3883 -38.3883 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2414 -4.2414 -4.2414 -4.2414 -4.1131 -4.1131 -4.1131 -4.1131 -0.3669 -0.3669 -0.3669 -0.3669 2.5058 2.5058 2.5058 2.5058 2.5855 2.5855 2.5855 2.5855 2.7346 2.7346 2.7346 2.7346 4.9548 4.9548 4.9548 4.9548 6.3851 6.3851 6.3851 6.3851 6.6836 6.6836 6.6836 6.6836 7.9246 7.9246 7.9246 7.9246 8.0736 8.0736 8.0736 8.0736 8.2189 8.2189 8.2189 8.2189 9.3118 9.3118 9.3118 9.3118 9.6415 9.6415 9.6415 9.6415 11.3803 11.3803 11.3803 11.3803 k = 0.0000 0.5000 0.2146 ( 15920 PWs) bands (ev): -69.8698 -69.8698 -69.8698 -69.8698 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3883 -38.3883 -38.3883 -38.3883 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2414 -4.2414 -4.2414 -4.2414 -4.1130 -4.1130 -4.1130 -4.1130 -0.3669 -0.3669 -0.3669 -0.3669 2.5058 2.5058 2.5058 2.5058 2.5855 2.5855 2.5855 2.5855 2.7345 2.7345 2.7345 2.7345 4.9540 4.9540 4.9540 4.9540 6.3860 6.3860 6.3860 6.3860 6.6831 6.6831 6.6831 6.6831 7.9236 7.9236 7.9236 7.9236 8.0753 8.0753 8.0753 8.0753 8.2182 8.2182 8.2182 8.2182 9.3152 9.3152 9.3152 9.3152 9.6408 9.6408 9.6408 9.6408 11.3883 11.3883 11.3883 11.3883 k = 0.0000 0.5000 0.2280 ( 15924 PWs) bands (ev): -69.8700 -69.8700 -69.8700 -69.8700 -39.6423 -39.6423 -39.6423 -39.6423 -38.4794 -38.4794 -38.4794 -38.4794 -38.3882 -38.3882 -38.3882 -38.3882 -19.4924 -19.4924 -19.4924 -19.4924 -15.8802 -15.8802 -15.8802 -15.8802 -6.1285 -6.1285 -6.1285 -6.1285 -4.2414 -4.2414 -4.2414 -4.2414 -4.1130 -4.1130 -4.1130 -4.1130 -0.3668 -0.3668 -0.3668 -0.3668 2.5058 2.5058 2.5058 2.5058 2.5855 2.5855 2.5855 2.5855 2.7344 2.7344 2.7344 2.7344 4.9537 4.9537 4.9537 4.9537 6.3862 6.3862 6.3862 6.3862 6.6828 6.6828 6.6828 6.6828 7.9226 7.9226 7.9226 7.9226 8.0753 8.0753 8.0753 8.0753 8.2188 8.2188 8.2188 8.2188 9.3158 9.3158 9.3158 9.3158 9.6402 9.6402 9.6402 9.6402 11.3911 11.3911 11.3911 11.3911 k = 0.5000 0.5000-0.0000 ( 15912 PWs) bands (ev): -69.8696 -69.8696 -69.8696 -69.8696 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1481 -6.1481 -6.1481 -6.1481 -4.2928 -4.2928 -4.2928 -4.2928 -4.0977 -4.0977 -4.0977 -4.0977 -0.1854 -0.1854 -0.1854 -0.1854 2.3812 2.3812 2.3812 2.3812 2.8237 2.8237 2.8237 2.8237 2.9440 2.9440 2.9440 2.9440 4.7024 4.7024 4.7024 4.7024 6.1824 6.1824 6.1824 6.1824 6.5837 6.5837 6.5837 6.5837 7.5983 7.5983 7.5983 7.5983 7.6108 7.6108 7.6108 7.6108 8.3132 8.3132 8.3132 8.3132 8.5444 8.5444 8.5444 8.5444 9.3806 9.3806 9.3806 9.3806 11.2656 11.2656 11.2656 11.2656 k = 0.5000 0.5000 0.0134 ( 15924 PWs) bands (ev): -69.8700 -69.8700 -69.8700 -69.8700 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1481 -6.1481 -6.1481 -6.1481 -4.2928 -4.2928 -4.2928 -4.2928 -4.0977 -4.0977 -4.0977 -4.0977 -0.1854 -0.1854 -0.1854 -0.1854 2.3812 2.3812 2.3812 2.3812 2.8237 2.8237 2.8237 2.8237 2.9440 2.9440 2.9440 2.9440 4.7025 4.7025 4.7025 4.7025 6.1824 6.1824 6.1824 6.1824 6.5835 6.5835 6.5835 6.5835 7.5962 7.5962 7.5962 7.5962 7.6095 7.6095 7.6095 7.6095 8.3131 8.3131 8.3131 8.3131 8.5443 8.5443 8.5443 8.5443 9.3790 9.3790 9.3790 9.3790 11.2683 11.2683 11.2683 11.2683 k = 0.5000 0.5000 0.0268 ( 15924 PWs) bands (ev): -69.8700 -69.8700 -69.8700 -69.8700 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1481 -6.1481 -6.1481 -6.1481 -4.2928 -4.2928 -4.2928 -4.2928 -4.0977 -4.0977 -4.0977 -4.0977 -0.1853 -0.1853 -0.1853 -0.1853 2.3809 2.3809 2.3809 2.3809 2.8237 2.8237 2.8237 2.8237 2.9439 2.9439 2.9439 2.9439 4.7024 4.7024 4.7024 4.7024 6.1822 6.1822 6.1822 6.1822 6.5832 6.5832 6.5832 6.5832 7.5959 7.5959 7.5959 7.5959 7.6088 7.6088 7.6088 7.6088 8.3131 8.3131 8.3131 8.3131 8.5472 8.5472 8.5472 8.5472 9.3784 9.3784 9.3784 9.3784 11.2776 11.2776 11.2776 11.2776 k = 0.5000 0.5000 0.0402 ( 15920 PWs) bands (ev): -69.8699 -69.8699 -69.8699 -69.8699 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1481 -6.1481 -6.1481 -6.1481 -4.2929 -4.2929 -4.2929 -4.2929 -4.0977 -4.0977 -4.0977 -4.0977 -0.1851 -0.1851 -0.1851 -0.1851 2.3805 2.3805 2.3805 2.3805 2.8237 2.8237 2.8237 2.8237 2.9438 2.9438 2.9438 2.9438 4.7026 4.7026 4.7026 4.7026 6.1820 6.1820 6.1820 6.1820 6.5831 6.5831 6.5831 6.5831 7.5962 7.5962 7.5962 7.5962 7.6103 7.6103 7.6103 7.6103 8.3138 8.3138 8.3138 8.3138 8.5466 8.5466 8.5466 8.5466 9.3769 9.3769 9.3769 9.3769 11.2946 11.2946 11.2946 11.2946 k = 0.5000 0.5000 0.0536 ( 15896 PWs) bands (ev): -69.8691 -69.8691 -69.8691 -69.8691 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1482 -6.1482 -6.1482 -6.1482 -4.2929 -4.2929 -4.2929 -4.2929 -4.0976 -4.0976 -4.0976 -4.0976 -0.1849 -0.1849 -0.1849 -0.1849 2.3800 2.3800 2.3800 2.3800 2.8237 2.8237 2.8237 2.8237 2.9437 2.9437 2.9437 2.9437 4.7032 4.7032 4.7032 4.7032 6.1818 6.1818 6.1818 6.1818 6.5830 6.5830 6.5830 6.5830 7.5995 7.5995 7.5995 7.5995 7.6128 7.6128 7.6128 7.6128 8.3147 8.3147 8.3147 8.3147 8.5463 8.5463 8.5463 8.5463 9.3805 9.3805 9.3805 9.3805 11.3181 11.3181 11.3181 11.3181 k = 0.5000 0.5000 0.0671 ( 15888 PWs) bands (ev): -69.8689 -69.8689 -69.8689 -69.8689 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1482 -6.1482 -6.1482 -6.1482 -4.2930 -4.2930 -4.2930 -4.2930 -4.0976 -4.0976 -4.0976 -4.0976 -0.1846 -0.1846 -0.1846 -0.1846 2.3793 2.3793 2.3793 2.3793 2.8237 2.8237 2.8237 2.8237 2.9435 2.9435 2.9435 2.9435 4.7036 4.7036 4.7036 4.7036 6.1815 6.1815 6.1815 6.1815 6.5825 6.5825 6.5825 6.5825 7.5998 7.5998 7.5998 7.5998 7.6132 7.6132 7.6132 7.6132 8.3154 8.3154 8.3154 8.3154 8.5484 8.5484 8.5484 8.5484 9.3807 9.3807 9.3807 9.3807 11.3469 11.3469 11.3469 11.3469 k = 0.5000 0.5000 0.0805 ( 15844 PWs) bands (ev): -69.8675 -69.8675 -69.8675 -69.8675 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3871 -38.3871 -38.3871 -38.3871 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1482 -6.1482 -6.1482 -6.1482 -4.2930 -4.2930 -4.2930 -4.2930 -4.0975 -4.0975 -4.0975 -4.0975 -0.1842 -0.1842 -0.1842 -0.1842 2.3786 2.3786 2.3786 2.3786 2.8237 2.8237 2.8237 2.8237 2.9434 2.9434 2.9434 2.9434 4.7041 4.7041 4.7041 4.7041 6.1811 6.1811 6.1811 6.1811 6.5822 6.5822 6.5822 6.5822 7.6042 7.6042 7.6042 7.6042 7.6163 7.6163 7.6163 7.6163 8.3163 8.3163 8.3163 8.3163 8.5545 8.5545 8.5545 8.5545 9.3862 9.3862 9.3862 9.3862 11.3827 11.3827 11.3827 11.3827 k = 0.5000 0.5000 0.0939 ( 15860 PWs) bands (ev): -69.8680 -69.8680 -69.8680 -69.8680 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3871 -38.3871 -38.3871 -38.3871 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1482 -6.1482 -6.1482 -6.1482 -4.2931 -4.2931 -4.2931 -4.2931 -4.0974 -4.0974 -4.0974 -4.0974 -0.1839 -0.1839 -0.1839 -0.1839 2.3777 2.3777 2.3777 2.3777 2.8237 2.8237 2.8237 2.8237 2.9432 2.9432 2.9432 2.9432 4.7045 4.7045 4.7045 4.7045 6.1805 6.1805 6.1805 6.1805 6.5814 6.5814 6.5814 6.5814 7.6050 7.6050 7.6050 7.6050 7.6153 7.6153 7.6153 7.6153 8.3142 8.3142 8.3142 8.3142 8.5506 8.5506 8.5506 8.5506 9.3857 9.3857 9.3857 9.3857 11.4223 11.4223 11.4223 11.4223 k = 0.5000 0.5000 0.1073 ( 15860 PWs) bands (ev): -69.8680 -69.8680 -69.8680 -69.8680 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3871 -38.3871 -38.3871 -38.3871 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1482 -6.1482 -6.1482 -6.1482 -4.2932 -4.2932 -4.2932 -4.2932 -4.0973 -4.0973 -4.0973 -4.0973 -0.1836 -0.1836 -0.1836 -0.1836 2.3768 2.3768 2.3768 2.3768 2.8237 2.8237 2.8237 2.8237 2.9430 2.9430 2.9430 2.9430 4.7049 4.7049 4.7049 4.7049 6.1801 6.1801 6.1801 6.1801 6.5805 6.5805 6.5805 6.5805 7.6043 7.6043 7.6043 7.6043 7.6141 7.6141 7.6141 7.6141 8.3165 8.3165 8.3165 8.3165 8.5514 8.5514 8.5514 8.5514 9.3853 9.3853 9.3853 9.3853 11.4674 11.4674 11.4674 11.4674 k = 0.5000 0.5000 0.1207 ( 15884 PWs) bands (ev): -69.8688 -69.8688 -69.8688 -69.8688 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1482 -6.1482 -6.1482 -6.1482 -4.2932 -4.2932 -4.2932 -4.2932 -4.0973 -4.0973 -4.0973 -4.0973 -0.1833 -0.1833 -0.1833 -0.1833 2.3759 2.3759 2.3759 2.3759 2.8236 2.8236 2.8236 2.8236 2.9428 2.9428 2.9428 2.9428 4.7053 4.7053 4.7053 4.7053 6.1795 6.1795 6.1795 6.1795 6.5796 6.5796 6.5796 6.5796 7.6027 7.6027 7.6027 7.6027 7.6124 7.6124 7.6124 7.6124 8.3147 8.3147 8.3147 8.3147 8.5480 8.5480 8.5480 8.5480 9.3836 9.3836 9.3836 9.3836 11.5174 11.5174 11.5174 11.5174 k = 0.5000 0.5000 0.1341 ( 15904 PWs) bands (ev): -69.8694 -69.8694 -69.8694 -69.8694 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1482 -6.1482 -6.1482 -6.1482 -4.2933 -4.2933 -4.2933 -4.2933 -4.0972 -4.0972 -4.0972 -4.0972 -0.1830 -0.1830 -0.1830 -0.1830 2.3750 2.3750 2.3750 2.3750 2.8236 2.8236 2.8236 2.8236 2.9425 2.9425 2.9425 2.9425 4.7058 4.7058 4.7058 4.7058 6.1788 6.1788 6.1788 6.1788 6.5789 6.5789 6.5789 6.5789 7.6017 7.6017 7.6017 7.6017 7.6112 7.6112 7.6112 7.6112 8.3121 8.3121 8.3121 8.3121 8.5448 8.5448 8.5448 8.5448 9.3824 9.3824 9.3824 9.3824 11.5727 11.5727 11.5727 11.5727 k = 0.5000 0.5000 0.1475 ( 15896 PWs) bands (ev): -69.8692 -69.8692 -69.8692 -69.8692 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1482 -6.1482 -6.1482 -6.1482 -4.2934 -4.2934 -4.2934 -4.2934 -4.0971 -4.0971 -4.0971 -4.0971 -0.1826 -0.1826 -0.1826 -0.1826 2.3742 2.3742 2.3742 2.3742 2.8236 2.8236 2.8236 2.8236 2.9424 2.9424 2.9424 2.9424 4.7062 4.7062 4.7062 4.7062 6.1784 6.1784 6.1784 6.1784 6.5784 6.5784 6.5784 6.5784 7.6020 7.6020 7.6020 7.6020 7.6117 7.6117 7.6117 7.6117 8.3127 8.3127 8.3127 8.3127 8.5465 8.5465 8.5465 8.5465 9.3824 9.3824 9.3824 9.3824 11.6330 11.6330 11.6330 11.6330 k = 0.5000 0.5000 0.1609 ( 15896 PWs) bands (ev): -69.8692 -69.8692 -69.8692 -69.8692 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1482 -6.1482 -6.1482 -6.1482 -4.2935 -4.2935 -4.2935 -4.2935 -4.0970 -4.0970 -4.0970 -4.0970 -0.1823 -0.1823 -0.1823 -0.1823 2.3734 2.3734 2.3734 2.3734 2.8236 2.8236 2.8236 2.8236 2.9422 2.9422 2.9422 2.9422 4.7065 4.7065 4.7065 4.7065 6.1780 6.1780 6.1780 6.1780 6.5778 6.5778 6.5778 6.5778 7.6021 7.6021 7.6021 7.6021 7.6113 7.6113 7.6113 7.6113 8.3134 8.3134 8.3134 8.3134 8.5476 8.5476 8.5476 8.5476 9.3814 9.3814 9.3814 9.3814 11.6952 11.6952 11.6952 11.6952 k = 0.5000 0.5000 0.1744 ( 15888 PWs) bands (ev): -69.8690 -69.8690 -69.8690 -69.8690 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1482 -6.1482 -6.1482 -6.1482 -4.2935 -4.2935 -4.2935 -4.2935 -4.0970 -4.0970 -4.0970 -4.0970 -0.1820 -0.1820 -0.1820 -0.1820 2.3728 2.3728 2.3728 2.3728 2.8236 2.8236 2.8236 2.8236 2.9420 2.9420 2.9420 2.9420 4.7069 4.7069 4.7069 4.7069 6.1776 6.1776 6.1776 6.1776 6.5774 6.5774 6.5774 6.5774 7.6030 7.6030 7.6030 7.6030 7.6119 7.6119 7.6119 7.6119 8.3132 8.3132 8.3132 8.3132 8.5488 8.5488 8.5488 8.5488 9.3824 9.3824 9.3824 9.3824 11.7592 11.7592 11.7592 11.7592 k = 0.5000 0.5000 0.1878 ( 15880 PWs) bands (ev): -69.8688 -69.8688 -69.8688 -69.8688 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1482 -6.1482 -6.1482 -6.1482 -4.2936 -4.2936 -4.2936 -4.2936 -4.0969 -4.0969 -4.0969 -4.0969 -0.1818 -0.1818 -0.1818 -0.1818 2.3722 2.3722 2.3722 2.3722 2.8236 2.8236 2.8236 2.8236 2.9419 2.9419 2.9419 2.9419 4.7072 4.7072 4.7072 4.7072 6.1773 6.1773 6.1773 6.1773 6.5770 6.5770 6.5770 6.5770 7.6041 7.6041 7.6041 7.6041 7.6128 7.6128 7.6128 7.6128 8.3130 8.3130 8.3130 8.3130 8.5493 8.5493 8.5493 8.5493 9.3836 9.3836 9.3836 9.3836 11.8217 11.8217 11.8217 11.8217 k = 0.5000 0.5000 0.2012 ( 15904 PWs) bands (ev): -69.8695 -69.8695 -69.8695 -69.8695 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1482 -6.1482 -6.1482 -6.1482 -4.2936 -4.2936 -4.2936 -4.2936 -4.0969 -4.0969 -4.0969 -4.0969 -0.1817 -0.1817 -0.1817 -0.1817 2.3718 2.3718 2.3718 2.3718 2.8236 2.8236 2.8236 2.8236 2.9418 2.9418 2.9418 2.9418 4.7074 4.7074 4.7074 4.7074 6.1770 6.1770 6.1770 6.1770 6.5766 6.5766 6.5766 6.5766 7.6030 7.6030 7.6030 7.6030 7.6117 7.6117 7.6117 7.6117 8.3122 8.3122 8.3122 8.3122 8.5436 8.5436 8.5436 8.5436 9.3807 9.3807 9.3807 9.3807 11.8775 11.8775 11.8775 11.8775 k = 0.5000 0.5000 0.2146 ( 15920 PWs) bands (ev): -69.8700 -69.8700 -69.8700 -69.8700 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1482 -6.1482 -6.1482 -6.1482 -4.2936 -4.2936 -4.2936 -4.2936 -4.0969 -4.0969 -4.0969 -4.0969 -0.1816 -0.1816 -0.1816 -0.1816 2.3716 2.3716 2.3716 2.3716 2.8236 2.8236 2.8236 2.8236 2.9418 2.9418 2.9418 2.9418 4.7074 4.7074 4.7074 4.7074 6.1768 6.1768 6.1768 6.1768 6.5764 6.5764 6.5764 6.5764 7.6024 7.6024 7.6024 7.6024 7.6113 7.6113 7.6113 7.6113 8.3104 8.3104 8.3104 8.3104 8.5412 8.5412 8.5412 8.5412 9.3781 9.3781 9.3781 9.3781 11.9191 11.9191 11.9191 11.9191 k = 0.5000 0.5000 0.2280 ( 15904 PWs) bands (ev): -69.8695 -69.8695 -69.8695 -69.8695 -39.6426 -39.6426 -39.6426 -39.6426 -38.4805 -38.4805 -38.4805 -38.4805 -38.3872 -38.3872 -38.3872 -38.3872 -19.4400 -19.4400 -19.4400 -19.4400 -15.9632 -15.9632 -15.9632 -15.9632 -6.1482 -6.1482 -6.1482 -6.1482 -4.2936 -4.2936 -4.2936 -4.2936 -4.0969 -4.0969 -4.0969 -4.0969 -0.1815 -0.1815 -0.1815 -0.1815 2.3715 2.3715 2.3715 2.3715 2.8236 2.8236 2.8236 2.8236 2.9417 2.9417 2.9417 2.9417 4.7075 4.7075 4.7075 4.7075 6.1769 6.1769 6.1769 6.1769 6.5764 6.5764 6.5764 6.5764 7.6037 7.6037 7.6037 7.6037 7.6124 7.6124 7.6124 7.6124 8.3130 8.3130 8.3130 8.3130 8.5426 8.5426 8.5426 8.5426 9.3786 9.3786 9.3786 9.3786 11.9351 11.9351 11.9351 11.9351 Writing output data file BaMnSbF.save init_run : 0.42s CPU 0.62s WALL ( 1 calls) electrons : 575.22s CPU 584.14s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.01s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 575.21s CPU 584.12s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.12s CPU 0.20s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.35s CPU 0.38s WALL ( 304 calls) cegterg : 528.30s CPU 535.58s WALL ( 318 calls) Called by sum_band: Called by *egterg: h_psi : 298.32s CPU 301.02s WALL ( 6066 calls) s_psi : 23.12s CPU 23.14s WALL ( 6066 calls) g_psi : 1.28s CPU 1.36s WALL ( 5444 calls) cdiaghg : 131.97s CPU 133.72s WALL ( 5748 calls) cegterg:over : 41.55s CPU 41.59s WALL ( 5444 calls) cegterg:upda : 39.54s CPU 39.41s WALL ( 5444 calls) cegterg:last : 18.90s CPU 18.93s WALL ( 926 calls) cdiaghg:chol : 8.00s CPU 8.10s WALL ( 5748 calls) cdiaghg:inve : 5.82s CPU 6.02s WALL ( 5748 calls) cdiaghg:para : 11.21s CPU 11.03s WALL ( 11496 calls) Called by h_psi: h_psi:vloc : 243.19s CPU 245.54s WALL ( 6066 calls) h_psi:vnl : 53.51s CPU 53.83s WALL ( 6066 calls) add_vuspsi : 28.60s CPU 28.91s WALL ( 6066 calls) General routines calbec : 24.89s CPU 24.89s WALL ( 6066 calls) fft : 0.01s CPU 0.01s WALL ( 15 calls) fftw : 231.24s CPU 233.35s WALL ( 1153476 calls) davcio : 0.17s CPU 0.57s WALL ( 608 calls) Parallel routines fft_scatter : 76.84s CPU 77.27s WALL ( 1153491 calls) PWSCF : 10m37.02s CPU 11m 6.94s WALL This run was terminated on: 14: 4:30 3Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=