Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 4:22:48 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 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 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: ./Rb2TeBr6.save/ file Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S renormalized file Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 5P renormalized file Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 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: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 51 39 10 2059 1387 196 Max 52 40 11 2064 1414 202 Sum 3679 2869 769 148309 100949 14361 bravais-lattice index = 14 lattice parameter (alat) = 14.3953 a.u. unit-cell volume = 2109.3396 (a.u.)^3 number of atoms/cell = 9 number of atomic types = 3 number of electrons = 66.00 number of Kohn-Sham states= 80 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 259.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 14.395293 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.500000 celldm(5)= 0.500000 celldm(6)= 0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.500000 0.866025 0.000000 ) a(3) = ( 0.500000 0.288675 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.577350 -0.408248 ) b(2) = ( 0.000000 1.154701 -0.408248 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for Br read from file: /users/gautes/Pseudo/Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5d639767687de88634f0d235e6526498 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 1213 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 PseudoPot. # 2 for Te read from file: /users/gautes/Pseudo/Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d7fe42880ce6991a805b4693d1f2335c Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1245 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. # 3 for Rb read from file: /users/gautes/Pseudo/Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 948b8f0a9070089a35782939cf30e963 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1219 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 atomic species valence mass pseudopotential Br 7.00 79.90400 Br( 1.00) Te 6.00 127.60000 Te( 1.00) Rb 9.00 85.46780 Rb( 1.00) 12 Sym. Ops., with inversion, found 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 [1,0,0] cryst. s( 2) = ( 1 0 0 ) ( 1 -1 0 ) ( 1 0 -1 ) cart. s( 2) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( -1 1 0 ) ( -1 0 0 ) ( -1 0 1 ) cart. s( 3) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( 0 -1 0 ) ( 1 -1 0 ) ( 0 -1 1 ) cart. s( 4) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( -1 1 0 ) ( 0 1 0 ) ( 0 1 -1 ) cart. s( 6) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 inversion cryst. s( 7) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 7) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( -1 1 0 ) ( -1 0 1 ) cart. s( 8) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( 1 -1 0 ) ( 1 0 0 ) ( 1 0 -1 ) cart. s( 9) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 0 1 0 ) ( -1 1 0 ) ( 0 1 -1 ) cart. s(10) = ( 0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(11) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 1 -1 0 ) ( 0 -1 0 ) ( 0 -1 1 ) cart. s(12) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_3d (-3m) there are 12 classes and 6 irreducible representations the character table: E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 2.00 -2.00 1.00 -1.00 0.00 0.00 2.00 -2.00 1.00 -1.00 0.00 0.00 G_5+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_6+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 2.00 -2.00 1.00 -1.00 0.00 0.00 -2.00 2.00 -1.00 1.00 0.00 0.00 G_5- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 G_6- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5+ 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_6+ 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5- 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_6- 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C3 3 4 120 deg rotation - cryst. axis [0,0,1] -2C3 -3 -4 120 deg rotation - cryst. axis [0,0,1] E 3C2' 2 5 -6 180 deg rotation - cart. axis [1,0,0] 3C2' 6 -5 -2 180 deg rotation - cryst. axis [1,1,0] i 7 inversion -i -7 inversion E 2S6 9 10 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -9 -10 inv. 120 deg rotation - cryst. axis [0,0,1] E 3s_v 8 11 -12 inv. 180 deg rotation - cart. axis [1,0,0] 3s_v 12 -11 -8 inv. 180 deg rotation - cryst. axis [1,1,0] Cartesian axes number of k points= 202 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049505 k( 2) = ( 0.0166667 -0.0096225 0.0136083), wk = 0.0049505 k( 3) = ( 0.0333333 -0.0192450 0.0272165), wk = 0.0049505 k( 4) = ( 0.0500000 -0.0288675 0.0408248), wk = 0.0049505 k( 5) = ( 0.0666667 -0.0384900 0.0544331), wk = 0.0049505 k( 6) = ( 0.0833333 -0.0481125 0.0680414), wk = 0.0049505 k( 7) = ( 0.1000000 -0.0577350 0.0816497), wk = 0.0049505 k( 8) = ( 0.1166667 -0.0673575 0.0952579), wk = 0.0049505 k( 9) = ( 0.1333333 -0.0769800 0.1088662), wk = 0.0049505 k( 10) = ( 0.1500000 -0.0866025 0.1224745), wk = 0.0049505 k( 11) = ( 0.1666667 -0.0962250 0.1360828), wk = 0.0049505 k( 12) = ( 0.1833333 -0.1058475 0.1496910), wk = 0.0049505 k( 13) = ( 0.2000000 -0.1154701 0.1632993), wk = 0.0049505 k( 14) = ( 0.2166667 -0.1250926 0.1769076), wk = 0.0049505 k( 15) = ( 0.2333333 -0.1347151 0.1905159), wk = 0.0049505 k( 16) = ( 0.2500000 -0.1443376 0.2041241), wk = 0.0049505 k( 17) = ( 0.2666667 -0.1539601 0.2177324), wk = 0.0049505 k( 18) = ( 0.2833333 -0.1635826 0.2313407), wk = 0.0049505 k( 19) = ( 0.3000000 -0.1732051 0.2449490), wk = 0.0049505 k( 20) = ( 0.3166667 -0.1828276 0.2585573), wk = 0.0049505 k( 21) = ( 0.3333333 -0.1924501 0.2721655), wk = 0.0049505 k( 22) = ( 0.3500000 -0.2020726 0.2857738), wk = 0.0049505 k( 23) = ( 0.3666667 -0.2116951 0.2993821), wk = 0.0049505 k( 24) = ( 0.3833333 -0.2213176 0.3129904), wk = 0.0049505 k( 25) = ( 0.4000000 -0.2309401 0.3265986), wk = 0.0049505 k( 26) = ( 0.4166667 -0.2405626 0.3402069), wk = 0.0049505 k( 27) = ( 0.4333333 -0.2501851 0.3538152), wk = 0.0049505 k( 28) = ( 0.4500000 -0.2598076 0.3674235), wk = 0.0049505 k( 29) = ( 0.4666667 -0.2694301 0.3810317), wk = 0.0049505 k( 30) = ( 0.4833333 -0.2790526 0.3946400), wk = 0.0049505 k( 31) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0049505 k( 32) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0049505 k( 33) = ( 0.5000000 -0.2694301 0.4218566), wk = 0.0049505 k( 34) = ( 0.5000000 -0.2501851 0.4354648), wk = 0.0049505 k( 35) = ( 0.5000000 -0.2309401 0.4490731), wk = 0.0049505 k( 36) = ( 0.5000000 -0.2116951 0.4626814), wk = 0.0049505 k( 37) = ( 0.5000000 -0.1924501 0.4762897), wk = 0.0049505 k( 38) = ( 0.5000000 -0.1732051 0.4898979), wk = 0.0049505 k( 39) = ( 0.5000000 -0.1539601 0.5035062), wk = 0.0049505 k( 40) = ( 0.5000000 -0.1347151 0.5171145), wk = 0.0049505 k( 41) = ( 0.5000000 -0.1154701 0.5307228), wk = 0.0049505 k( 42) = ( 0.5000000 -0.0962250 0.5443311), wk = 0.0049505 k( 43) = ( 0.5000000 -0.0769800 0.5579393), wk = 0.0049505 k( 44) = ( 0.5000000 -0.0577350 0.5715476), wk = 0.0049505 k( 45) = ( 0.5000000 -0.0384900 0.5851559), wk = 0.0049505 k( 46) = ( 0.5000000 -0.0192450 0.5987642), wk = 0.0049505 k( 47) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0049505 k( 48) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0049505 k( 49) = ( 0.4886364 0.0196824 0.6123724), wk = 0.0049505 k( 50) = ( 0.4772727 0.0393648 0.6123724), wk = 0.0049505 k( 51) = ( 0.4659091 0.0590472 0.6123724), wk = 0.0049505 k( 52) = ( 0.4545455 0.0787296 0.6123724), wk = 0.0049505 k( 53) = ( 0.4431818 0.0984120 0.6123724), wk = 0.0049505 k( 54) = ( 0.4318182 0.1180944 0.6123724), wk = 0.0049505 k( 55) = ( 0.4204545 0.1377768 0.6123724), wk = 0.0049505 k( 56) = ( 0.4090909 0.1574592 0.6123724), wk = 0.0049505 k( 57) = ( 0.3977273 0.1771416 0.6123724), wk = 0.0049505 k( 58) = ( 0.3863636 0.1968239 0.6123724), wk = 0.0049505 k( 59) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0049505 k( 60) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0049505 k( 61) = ( 0.3629032 0.2095223 0.5926185), wk = 0.0049505 k( 62) = ( 0.3508064 0.2025382 0.5728645), wk = 0.0049505 k( 63) = ( 0.3387097 0.1955541 0.5531106), wk = 0.0049505 k( 64) = ( 0.3266129 0.1885700 0.5333566), wk = 0.0049505 k( 65) = ( 0.3145161 0.1815860 0.5136027), wk = 0.0049505 k( 66) = ( 0.3024193 0.1746019 0.4938487), wk = 0.0049505 k( 67) = ( 0.2903226 0.1676178 0.4740948), wk = 0.0049505 k( 68) = ( 0.2782258 0.1606337 0.4543408), wk = 0.0049505 k( 69) = ( 0.2661290 0.1536497 0.4345869), wk = 0.0049505 k( 70) = ( 0.2540323 0.1466656 0.4148329), wk = 0.0049505 k( 71) = ( 0.2419355 0.1396815 0.3950790), wk = 0.0049505 k( 72) = ( 0.2298387 0.1326974 0.3753250), wk = 0.0049505 k( 73) = ( 0.2177419 0.1257134 0.3555711), wk = 0.0049505 k( 74) = ( 0.2056452 0.1187293 0.3358171), wk = 0.0049505 k( 75) = ( 0.1935484 0.1117452 0.3160632), wk = 0.0049505 k( 76) = ( 0.1814516 0.1047611 0.2963093), wk = 0.0049505 k( 77) = ( 0.1693548 0.0977771 0.2765553), wk = 0.0049505 k( 78) = ( 0.1572581 0.0907930 0.2568013), wk = 0.0049505 k( 79) = ( 0.1451613 0.0838089 0.2370474), wk = 0.0049505 k( 80) = ( 0.1330645 0.0768248 0.2172934), wk = 0.0049505 k( 81) = ( 0.1209677 0.0698408 0.1975395), wk = 0.0049505 k( 82) = ( 0.1088710 0.0628567 0.1777855), wk = 0.0049505 k( 83) = ( 0.0967742 0.0558726 0.1580316), wk = 0.0049505 k( 84) = ( 0.0846774 0.0488885 0.1382776), wk = 0.0049505 k( 85) = ( 0.0725806 0.0419045 0.1185237), wk = 0.0049505 k( 86) = ( 0.0604839 0.0349204 0.0987697), wk = 0.0049505 k( 87) = ( 0.0483871 0.0279363 0.0790158), wk = 0.0049505 k( 88) = ( 0.0362903 0.0209522 0.0592619), wk = 0.0049505 k( 89) = ( 0.0241936 0.0139682 0.0395079), wk = 0.0049505 k( 90) = ( 0.0120968 0.0069841 0.0197540), wk = 0.0049505 k( 91) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049505 k( 92) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049505 k( 93) = ( 0.0192308 0.0111029 0.0078509), wk = 0.0049505 k( 94) = ( 0.0384615 0.0222058 0.0157019), wk = 0.0049505 k( 95) = ( 0.0576923 0.0333087 0.0235528), wk = 0.0049505 k( 96) = ( 0.0769231 0.0444116 0.0314037), wk = 0.0049505 k( 97) = ( 0.0961538 0.0555145 0.0392546), wk = 0.0049505 k( 98) = ( 0.1153846 0.0666173 0.0471056), wk = 0.0049505 k( 99) = ( 0.1346154 0.0777202 0.0549565), wk = 0.0049505 k( 100) = ( 0.1538461 0.0888231 0.0628074), wk = 0.0049505 k( 101) = ( 0.1730769 0.0999260 0.0706584), wk = 0.0049505 k( 102) = ( 0.1923077 0.1110289 0.0785093), wk = 0.0049505 k( 103) = ( 0.2115385 0.1221318 0.0863602), wk = 0.0049505 k( 104) = ( 0.2307692 0.1332347 0.0942111), wk = 0.0049505 k( 105) = ( 0.2500000 0.1443376 0.1020621), wk = 0.0049505 k( 106) = ( 0.2692308 0.1554405 0.1099130), wk = 0.0049505 k( 107) = ( 0.2884615 0.1665433 0.1177639), wk = 0.0049505 k( 108) = ( 0.3076923 0.1776462 0.1256149), wk = 0.0049505 k( 109) = ( 0.3269231 0.1887491 0.1334658), wk = 0.0049505 k( 110) = ( 0.3461538 0.1998520 0.1413167), wk = 0.0049505 k( 111) = ( 0.3653846 0.2109549 0.1491676), wk = 0.0049505 k( 112) = ( 0.3846154 0.2220578 0.1570186), wk = 0.0049505 k( 113) = ( 0.4038462 0.2331607 0.1648695), wk = 0.0049505 k( 114) = ( 0.4230769 0.2442636 0.1727204), wk = 0.0049505 k( 115) = ( 0.4423077 0.2553665 0.1805714), wk = 0.0049505 k( 116) = ( 0.4615385 0.2664694 0.1884223), wk = 0.0049505 k( 117) = ( 0.4807692 0.2775722 0.1962732), wk = 0.0049505 k( 118) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0049505 k( 119) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0049505 k( 120) = ( 0.5069444 0.2686283 0.2154644), wk = 0.0049505 k( 121) = ( 0.5138889 0.2485814 0.2268046), wk = 0.0049505 k( 122) = ( 0.5208333 0.2285345 0.2381448), wk = 0.0049505 k( 123) = ( 0.5277778 0.2084876 0.2494851), wk = 0.0049505 k( 124) = ( 0.5347222 0.1884407 0.2608253), wk = 0.0049505 k( 125) = ( 0.5416667 0.1683938 0.2721655), wk = 0.0049505 k( 126) = ( 0.5486111 0.1483469 0.2835058), wk = 0.0049505 k( 127) = ( 0.5555556 0.1283001 0.2948460), wk = 0.0049505 k( 128) = ( 0.5625000 0.1082532 0.3061862), wk = 0.0049505 k( 129) = ( 0.5694444 0.0882063 0.3175264), wk = 0.0049505 k( 130) = ( 0.5763889 0.0681594 0.3288667), wk = 0.0049505 k( 131) = ( 0.5833333 0.0481125 0.3402069), wk = 0.0049505 k( 132) = ( 0.5902778 0.0280656 0.3515471), wk = 0.0049505 k( 133) = ( 0.5972222 0.0080188 0.3628874), wk = 0.0049505 k( 134) = ( 0.6041667 -0.0120281 0.3742276), wk = 0.0049505 k( 135) = ( 0.6111111 -0.0320750 0.3855678), wk = 0.0049505 k( 136) = ( 0.6180556 -0.0521219 0.3969081), wk = 0.0049505 k( 137) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0049505 k( 138) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0049505 k( 139) = ( 0.6136364 -0.0656080 0.4268050), wk = 0.0049505 k( 140) = ( 0.6022727 -0.0590472 0.4453618), wk = 0.0049505 k( 141) = ( 0.5909091 -0.0524864 0.4639185), wk = 0.0049505 k( 142) = ( 0.5795455 -0.0459256 0.4824753), wk = 0.0049505 k( 143) = ( 0.5681818 -0.0393648 0.5010320), wk = 0.0049505 k( 144) = ( 0.5568182 -0.0328040 0.5195887), wk = 0.0049505 k( 145) = ( 0.5454545 -0.0262432 0.5381455), wk = 0.0049505 k( 146) = ( 0.5340909 -0.0196824 0.5567022), wk = 0.0049505 k( 147) = ( 0.5227273 -0.0131216 0.5752590), wk = 0.0049505 k( 148) = ( 0.5113636 -0.0065608 0.5938157), wk = 0.0049505 k( 149) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0049505 k( 150) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0049505 k( 151) = ( 0.5000000 0.0137464 0.5929320), wk = 0.0049505 k( 152) = ( 0.5000000 0.0274929 0.5734917), wk = 0.0049505 k( 153) = ( 0.5000000 0.0412393 0.5540512), wk = 0.0049505 k( 154) = ( 0.5000000 0.0549857 0.5346109), wk = 0.0049505 k( 155) = ( 0.5000000 0.0687322 0.5151705), wk = 0.0049505 k( 156) = ( 0.5000000 0.0824786 0.4957301), wk = 0.0049505 k( 157) = ( 0.5000000 0.0962250 0.4762897), wk = 0.0049505 k( 158) = ( 0.5000000 0.1099715 0.4568493), wk = 0.0049505 k( 159) = ( 0.5000000 0.1237179 0.4374089), wk = 0.0049505 k( 160) = ( 0.5000000 0.1374644 0.4179685), wk = 0.0049505 k( 161) = ( 0.5000000 0.1512108 0.3985281), wk = 0.0049505 k( 162) = ( 0.5000000 0.1649572 0.3790877), wk = 0.0049505 k( 163) = ( 0.5000000 0.1787036 0.3596473), wk = 0.0049505 k( 164) = ( 0.5000000 0.1924501 0.3402069), wk = 0.0049505 k( 165) = ( 0.5000000 0.2061965 0.3207665), wk = 0.0049505 k( 166) = ( 0.5000000 0.2199430 0.3013261), wk = 0.0049505 k( 167) = ( 0.5000000 0.2336894 0.2818857), wk = 0.0049505 k( 168) = ( 0.5000000 0.2474358 0.2624453), wk = 0.0049505 k( 169) = ( 0.5000000 0.2611823 0.2430049), wk = 0.0049505 k( 170) = ( 0.5000000 0.2749287 0.2235645), wk = 0.0049505 k( 171) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0049505 k( 172) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0049505 k( 173) = ( 0.4930556 0.2846658 0.2268046), wk = 0.0049505 k( 174) = ( 0.4861111 0.2806564 0.2494851), wk = 0.0049505 k( 175) = ( 0.4791667 0.2766470 0.2721655), wk = 0.0049505 k( 176) = ( 0.4722222 0.2726376 0.2948460), wk = 0.0049505 k( 177) = ( 0.4652778 0.2686283 0.3175264), wk = 0.0049505 k( 178) = ( 0.4583333 0.2646189 0.3402069), wk = 0.0049505 k( 179) = ( 0.4513889 0.2606095 0.3628874), wk = 0.0049505 k( 180) = ( 0.4444444 0.2566001 0.3855678), wk = 0.0049505 k( 181) = ( 0.4375000 0.2525907 0.4082483), wk = 0.0049505 k( 182) = ( 0.4305556 0.2485814 0.4309287), wk = 0.0049505 k( 183) = ( 0.4236111 0.2445720 0.4536092), wk = 0.0049505 k( 184) = ( 0.4166667 0.2405626 0.4762897), wk = 0.0049505 k( 185) = ( 0.4097222 0.2365532 0.4989701), wk = 0.0049505 k( 186) = ( 0.4027778 0.2325439 0.5216506), wk = 0.0049505 k( 187) = ( 0.3958333 0.2285345 0.5443311), wk = 0.0049505 k( 188) = ( 0.3888889 0.2245251 0.5670115), wk = 0.0049505 k( 189) = ( 0.3819444 0.2205157 0.5896920), wk = 0.0049505 k( 190) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0049505 k( 191) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0049505 k( 192) = ( 0.6136364 -0.0918512 0.4082483), wk = 0.0049505 k( 193) = ( 0.6022727 -0.1115336 0.4082483), wk = 0.0049505 k( 194) = ( 0.5909091 -0.1312160 0.4082483), wk = 0.0049505 k( 195) = ( 0.5795455 -0.1508984 0.4082483), wk = 0.0049505 k( 196) = ( 0.5681818 -0.1705808 0.4082483), wk = 0.0049505 k( 197) = ( 0.5568182 -0.1902632 0.4082483), wk = 0.0049505 k( 198) = ( 0.5454545 -0.2099456 0.4082483), wk = 0.0049505 k( 199) = ( 0.5340909 -0.2296279 0.4082483), wk = 0.0049505 k( 200) = ( 0.5227273 -0.2493103 0.4082483), wk = 0.0049505 k( 201) = ( 0.5113636 -0.2689927 0.4082483), wk = 0.0049505 k( 202) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0049505 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049505 k( 2) = ( 0.0166667 -0.0000000 0.0166667), wk = 0.0049505 k( 3) = ( 0.0333333 -0.0000000 0.0333333), wk = 0.0049505 k( 4) = ( 0.0500000 -0.0000000 0.0500000), wk = 0.0049505 k( 5) = ( 0.0666667 -0.0000000 0.0666667), wk = 0.0049505 k( 6) = ( 0.0833333 0.0000000 0.0833333), wk = 0.0049505 k( 7) = ( 0.1000000 -0.0000000 0.1000000), wk = 0.0049505 k( 8) = ( 0.1166667 -0.0000000 0.1166667), wk = 0.0049505 k( 9) = ( 0.1333333 -0.0000000 0.1333333), wk = 0.0049505 k( 10) = ( 0.1500000 -0.0000000 0.1500000), wk = 0.0049505 k( 11) = ( 0.1666667 -0.0000000 0.1666667), wk = 0.0049505 k( 12) = ( 0.1833333 0.0000000 0.1833333), wk = 0.0049505 k( 13) = ( 0.2000000 -0.0000000 0.2000000), wk = 0.0049505 k( 14) = ( 0.2166667 -0.0000000 0.2166667), wk = 0.0049505 k( 15) = ( 0.2333333 -0.0000000 0.2333333), wk = 0.0049505 k( 16) = ( 0.2500000 -0.0000000 0.2500000), wk = 0.0049505 k( 17) = ( 0.2666667 -0.0000000 0.2666667), wk = 0.0049505 k( 18) = ( 0.2833333 -0.0000000 0.2833333), wk = 0.0049505 k( 19) = ( 0.3000000 -0.0000000 0.3000000), wk = 0.0049505 k( 20) = ( 0.3166667 -0.0000000 0.3166667), wk = 0.0049505 k( 21) = ( 0.3333333 -0.0000000 0.3333333), wk = 0.0049505 k( 22) = ( 0.3500000 -0.0000000 0.3500000), wk = 0.0049505 k( 23) = ( 0.3666667 -0.0000000 0.3666667), wk = 0.0049505 k( 24) = ( 0.3833333 -0.0000000 0.3833333), wk = 0.0049505 k( 25) = ( 0.4000000 -0.0000000 0.4000000), wk = 0.0049505 k( 26) = ( 0.4166667 -0.0000000 0.4166667), wk = 0.0049505 k( 27) = ( 0.4333333 0.0000000 0.4333333), wk = 0.0049505 k( 28) = ( 0.4500000 0.0000000 0.4500000), wk = 0.0049505 k( 29) = ( 0.4666667 0.0000000 0.4666667), wk = 0.0049505 k( 30) = ( 0.4833333 -0.0000000 0.4833333), wk = 0.0049505 k( 31) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0049505 k( 32) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0049505 k( 33) = ( 0.5000000 0.0166667 0.5166667), wk = 0.0049505 k( 34) = ( 0.5000000 0.0333333 0.5333333), wk = 0.0049505 k( 35) = ( 0.5000000 0.0500000 0.5500000), wk = 0.0049505 k( 36) = ( 0.5000000 0.0666667 0.5666667), wk = 0.0049505 k( 37) = ( 0.5000000 0.0833333 0.5833333), wk = 0.0049505 k( 38) = ( 0.5000000 0.1000000 0.6000000), wk = 0.0049505 k( 39) = ( 0.5000000 0.1166667 0.6166667), wk = 0.0049505 k( 40) = ( 0.5000000 0.1333333 0.6333333), wk = 0.0049505 k( 41) = ( 0.5000000 0.1500000 0.6500000), wk = 0.0049505 k( 42) = ( 0.5000000 0.1666667 0.6666667), wk = 0.0049505 k( 43) = ( 0.5000000 0.1833333 0.6833333), wk = 0.0049505 k( 44) = ( 0.5000000 0.2000000 0.7000000), wk = 0.0049505 k( 45) = ( 0.5000000 0.2166667 0.7166667), wk = 0.0049505 k( 46) = ( 0.5000000 0.2333333 0.7333333), wk = 0.0049505 k( 47) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0049505 k( 48) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0049505 k( 49) = ( 0.4886364 0.2613636 0.7500000), wk = 0.0049505 k( 50) = ( 0.4772727 0.2727273 0.7500000), wk = 0.0049505 k( 51) = ( 0.4659091 0.2840909 0.7500000), wk = 0.0049505 k( 52) = ( 0.4545455 0.2954545 0.7500000), wk = 0.0049505 k( 53) = ( 0.4431818 0.3068182 0.7500000), wk = 0.0049505 k( 54) = ( 0.4318182 0.3181818 0.7500000), wk = 0.0049505 k( 55) = ( 0.4204545 0.3295455 0.7500000), wk = 0.0049505 k( 56) = ( 0.4090909 0.3409091 0.7500000), wk = 0.0049505 k( 57) = ( 0.3977273 0.3522727 0.7500000), wk = 0.0049505 k( 58) = ( 0.3863636 0.3636364 0.7500000), wk = 0.0049505 k( 59) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0049505 k( 60) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0049505 k( 61) = ( 0.3629032 0.3629032 0.7258065), wk = 0.0049505 k( 62) = ( 0.3508064 0.3508064 0.7016129), wk = 0.0049505 k( 63) = ( 0.3387097 0.3387097 0.6774193), wk = 0.0049505 k( 64) = ( 0.3266129 0.3266129 0.6532258), wk = 0.0049505 k( 65) = ( 0.3145161 0.3145161 0.6290323), wk = 0.0049505 k( 66) = ( 0.3024193 0.3024193 0.6048387), wk = 0.0049505 k( 67) = ( 0.2903226 0.2903226 0.5806452), wk = 0.0049505 k( 68) = ( 0.2782258 0.2782258 0.5564516), wk = 0.0049505 k( 69) = ( 0.2661290 0.2661290 0.5322581), wk = 0.0049505 k( 70) = ( 0.2540323 0.2540323 0.5080645), wk = 0.0049505 k( 71) = ( 0.2419355 0.2419355 0.4838710), wk = 0.0049505 k( 72) = ( 0.2298387 0.2298387 0.4596774), wk = 0.0049505 k( 73) = ( 0.2177419 0.2177419 0.4354839), wk = 0.0049505 k( 74) = ( 0.2056452 0.2056452 0.4112903), wk = 0.0049505 k( 75) = ( 0.1935484 0.1935484 0.3870968), wk = 0.0049505 k( 76) = ( 0.1814516 0.1814516 0.3629032), wk = 0.0049505 k( 77) = ( 0.1693548 0.1693548 0.3387097), wk = 0.0049505 k( 78) = ( 0.1572581 0.1572581 0.3145161), wk = 0.0049505 k( 79) = ( 0.1451613 0.1451613 0.2903226), wk = 0.0049505 k( 80) = ( 0.1330645 0.1330645 0.2661290), wk = 0.0049505 k( 81) = ( 0.1209677 0.1209677 0.2419355), wk = 0.0049505 k( 82) = ( 0.1088710 0.1088710 0.2177419), wk = 0.0049505 k( 83) = ( 0.0967742 0.0967742 0.1935484), wk = 0.0049505 k( 84) = ( 0.0846774 0.0846774 0.1693548), wk = 0.0049505 k( 85) = ( 0.0725806 0.0725806 0.1451613), wk = 0.0049505 k( 86) = ( 0.0604839 0.0604839 0.1209677), wk = 0.0049505 k( 87) = ( 0.0483871 0.0483871 0.0967742), wk = 0.0049505 k( 88) = ( 0.0362903 0.0362903 0.0725806), wk = 0.0049505 k( 89) = ( 0.0241936 0.0241936 0.0483871), wk = 0.0049505 k( 90) = ( 0.0120968 0.0120968 0.0241936), wk = 0.0049505 k( 91) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049505 k( 92) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049505 k( 93) = ( 0.0192308 0.0192308 0.0192308), wk = 0.0049505 k( 94) = ( 0.0384615 0.0384615 0.0384615), wk = 0.0049505 k( 95) = ( 0.0576923 0.0576923 0.0576923), wk = 0.0049505 k( 96) = ( 0.0769231 0.0769231 0.0769231), wk = 0.0049505 k( 97) = ( 0.0961538 0.0961538 0.0961538), wk = 0.0049505 k( 98) = ( 0.1153846 0.1153846 0.1153846), wk = 0.0049505 k( 99) = ( 0.1346154 0.1346154 0.1346154), wk = 0.0049505 k( 100) = ( 0.1538461 0.1538461 0.1538462), wk = 0.0049505 k( 101) = ( 0.1730769 0.1730769 0.1730769), wk = 0.0049505 k( 102) = ( 0.1923077 0.1923077 0.1923077), wk = 0.0049505 k( 103) = ( 0.2115385 0.2115385 0.2115385), wk = 0.0049505 k( 104) = ( 0.2307692 0.2307692 0.2307692), wk = 0.0049505 k( 105) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0049505 k( 106) = ( 0.2692308 0.2692308 0.2692308), wk = 0.0049505 k( 107) = ( 0.2884615 0.2884615 0.2884615), wk = 0.0049505 k( 108) = ( 0.3076923 0.3076923 0.3076923), wk = 0.0049505 k( 109) = ( 0.3269231 0.3269231 0.3269231), wk = 0.0049505 k( 110) = ( 0.3461538 0.3461538 0.3461538), wk = 0.0049505 k( 111) = ( 0.3653846 0.3653846 0.3653846), wk = 0.0049505 k( 112) = ( 0.3846154 0.3846154 0.3846154), wk = 0.0049505 k( 113) = ( 0.4038462 0.4038461 0.4038462), wk = 0.0049505 k( 114) = ( 0.4230769 0.4230769 0.4230769), wk = 0.0049505 k( 115) = ( 0.4423077 0.4423077 0.4423077), wk = 0.0049505 k( 116) = ( 0.4615385 0.4615385 0.4615385), wk = 0.0049505 k( 117) = ( 0.4807692 0.4807692 0.4807692), wk = 0.0049505 k( 118) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0049505 k( 119) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0049505 k( 120) = ( 0.5069444 0.4861111 0.5069444), wk = 0.0049505 k( 121) = ( 0.5138889 0.4722222 0.5138889), wk = 0.0049505 k( 122) = ( 0.5208333 0.4583333 0.5208333), wk = 0.0049505 k( 123) = ( 0.5277778 0.4444444 0.5277778), wk = 0.0049505 k( 124) = ( 0.5347222 0.4305556 0.5347222), wk = 0.0049505 k( 125) = ( 0.5416667 0.4166667 0.5416667), wk = 0.0049505 k( 126) = ( 0.5486111 0.4027778 0.5486111), wk = 0.0049505 k( 127) = ( 0.5555556 0.3888889 0.5555556), wk = 0.0049505 k( 128) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0049505 k( 129) = ( 0.5694444 0.3611111 0.5694444), wk = 0.0049505 k( 130) = ( 0.5763889 0.3472222 0.5763889), wk = 0.0049505 k( 131) = ( 0.5833333 0.3333333 0.5833333), wk = 0.0049505 k( 132) = ( 0.5902778 0.3194444 0.5902778), wk = 0.0049505 k( 133) = ( 0.5972222 0.3055556 0.5972222), wk = 0.0049505 k( 134) = ( 0.6041667 0.2916667 0.6041667), wk = 0.0049505 k( 135) = ( 0.6111111 0.2777778 0.6111111), wk = 0.0049505 k( 136) = ( 0.6180556 0.2638889 0.6180556), wk = 0.0049505 k( 137) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0049505 k( 138) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0049505 k( 139) = ( 0.6136364 0.2500000 0.6363636), wk = 0.0049505 k( 140) = ( 0.6022727 0.2500000 0.6477273), wk = 0.0049505 k( 141) = ( 0.5909091 0.2500000 0.6590909), wk = 0.0049505 k( 142) = ( 0.5795455 0.2500000 0.6704546), wk = 0.0049505 k( 143) = ( 0.5681818 0.2500000 0.6818182), wk = 0.0049505 k( 144) = ( 0.5568182 0.2500000 0.6931818), wk = 0.0049505 k( 145) = ( 0.5454545 0.2500000 0.7045455), wk = 0.0049505 k( 146) = ( 0.5340909 0.2500000 0.7159091), wk = 0.0049505 k( 147) = ( 0.5227273 0.2500000 0.7272727), wk = 0.0049505 k( 148) = ( 0.5113636 0.2500000 0.7386364), wk = 0.0049505 k( 149) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0049505 k( 150) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0049505 k( 151) = ( 0.5000000 0.2619048 0.7380952), wk = 0.0049505 k( 152) = ( 0.5000000 0.2738095 0.7261905), wk = 0.0049505 k( 153) = ( 0.5000000 0.2857143 0.7142857), wk = 0.0049505 k( 154) = ( 0.5000000 0.2976190 0.7023810), wk = 0.0049505 k( 155) = ( 0.5000000 0.3095238 0.6904762), wk = 0.0049505 k( 156) = ( 0.5000000 0.3214286 0.6785714), wk = 0.0049505 k( 157) = ( 0.5000000 0.3333333 0.6666667), wk = 0.0049505 k( 158) = ( 0.5000000 0.3452381 0.6547619), wk = 0.0049505 k( 159) = ( 0.5000000 0.3571429 0.6428571), wk = 0.0049505 k( 160) = ( 0.5000000 0.3690476 0.6309524), wk = 0.0049505 k( 161) = ( 0.5000000 0.3809524 0.6190476), wk = 0.0049505 k( 162) = ( 0.5000000 0.3928571 0.6071429), wk = 0.0049505 k( 163) = ( 0.5000000 0.4047619 0.5952381), wk = 0.0049505 k( 164) = ( 0.5000000 0.4166667 0.5833333), wk = 0.0049505 k( 165) = ( 0.5000000 0.4285714 0.5714286), wk = 0.0049505 k( 166) = ( 0.5000000 0.4404762 0.5595238), wk = 0.0049505 k( 167) = ( 0.5000000 0.4523810 0.5476190), wk = 0.0049505 k( 168) = ( 0.5000000 0.4642857 0.5357143), wk = 0.0049505 k( 169) = ( 0.5000000 0.4761905 0.5238095), wk = 0.0049505 k( 170) = ( 0.5000000 0.4880952 0.5119048), wk = 0.0049505 k( 171) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0049505 k( 172) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0049505 k( 173) = ( 0.4930556 0.4930556 0.5138889), wk = 0.0049505 k( 174) = ( 0.4861111 0.4861111 0.5277778), wk = 0.0049505 k( 175) = ( 0.4791667 0.4791667 0.5416667), wk = 0.0049505 k( 176) = ( 0.4722222 0.4722222 0.5555556), wk = 0.0049505 k( 177) = ( 0.4652778 0.4652778 0.5694444), wk = 0.0049505 k( 178) = ( 0.4583333 0.4583333 0.5833333), wk = 0.0049505 k( 179) = ( 0.4513889 0.4513889 0.5972222), wk = 0.0049505 k( 180) = ( 0.4444444 0.4444444 0.6111111), wk = 0.0049505 k( 181) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0049505 k( 182) = ( 0.4305556 0.4305556 0.6388889), wk = 0.0049505 k( 183) = ( 0.4236111 0.4236111 0.6527778), wk = 0.0049505 k( 184) = ( 0.4166667 0.4166667 0.6666667), wk = 0.0049505 k( 185) = ( 0.4097222 0.4097222 0.6805556), wk = 0.0049505 k( 186) = ( 0.4027778 0.4027778 0.6944444), wk = 0.0049505 k( 187) = ( 0.3958333 0.3958333 0.7083333), wk = 0.0049505 k( 188) = ( 0.3888889 0.3888889 0.7222222), wk = 0.0049505 k( 189) = ( 0.3819444 0.3819444 0.7361111), wk = 0.0049505 k( 190) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0049505 k( 191) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0049505 k( 192) = ( 0.6136364 0.2272727 0.6136364), wk = 0.0049505 k( 193) = ( 0.6022727 0.2045454 0.6022727), wk = 0.0049505 k( 194) = ( 0.5909091 0.1818182 0.5909091), wk = 0.0049505 k( 195) = ( 0.5795455 0.1590909 0.5795455), wk = 0.0049505 k( 196) = ( 0.5681818 0.1363636 0.5681818), wk = 0.0049505 k( 197) = ( 0.5568182 0.1136364 0.5568182), wk = 0.0049505 k( 198) = ( 0.5454545 0.0909091 0.5454545), wk = 0.0049505 k( 199) = ( 0.5340909 0.0681818 0.5340909), wk = 0.0049505 k( 200) = ( 0.5227273 0.0454545 0.5227273), wk = 0.0049505 k( 201) = ( 0.5113636 0.0227273 0.5113636), wk = 0.0049505 k( 202) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0049505 Dense grid: 148309 G-vectors FFT dimensions: ( 75, 75, 75) Smooth grid: 100949 G-vectors FFT dimensions: ( 72, 72, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.43 Mb ( 352, 80) NL pseudopotentials 0.50 Mb ( 176, 186) Each V/rho on FFT grid 0.17 Mb ( 11250) Each G-vector array 0.02 Mb ( 2060) G-vector shells 0.01 Mb ( 709) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.72 Mb ( 352, 320) Each subspace H/S matrix 0.04 Mb ( 53, 53) Each matrix 0.45 Mb ( 186, 2, 80) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./Rb2TeBr6.save/charge-density.dat Starting wfc are 88 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.0 secs Computing kpt #: 2 total cpu time spent up to now is 5.7 secs Computing kpt #: 3 total cpu time spent up to now is 7.2 secs Computing kpt #: 4 total cpu time spent up to now is 8.7 secs Computing kpt #: 5 total cpu time spent up to now is 10.2 secs Computing kpt #: 6 total cpu time spent up to now is 11.7 secs Computing kpt #: 7 total cpu time spent up to now is 13.3 secs Computing kpt #: 8 total cpu time spent up to now is 14.9 secs Computing kpt #: 9 total cpu time spent up to now is 16.4 secs Computing kpt #: 10 total cpu time spent up to now is 17.9 secs Computing kpt #: 11 total cpu time spent up to now is 19.5 secs Computing kpt #: 12 total cpu time spent up to now is 21.2 secs Computing kpt #: 13 total cpu time spent up to now is 22.8 secs Computing kpt #: 14 total cpu time spent up to now is 24.5 secs Computing kpt #: 15 total cpu time spent up to now is 26.1 secs Computing kpt #: 16 total cpu time spent up to now is 27.9 secs Computing kpt #: 17 total cpu time spent up to now is 29.5 secs Computing kpt #: 18 total cpu time spent up to now is 31.6 secs Computing kpt #: 19 total cpu time spent up to now is 33.7 secs Computing kpt #: 20 total cpu time spent up to now is 35.6 secs Computing kpt #: 21 total cpu time spent up to now is 37.9 secs Computing kpt #: 22 total cpu time spent up to now is 39.7 secs Computing kpt #: 23 total cpu time spent up to now is 41.5 secs Computing kpt #: 24 total cpu time spent up to now is 43.2 secs Computing kpt #: 25 total cpu time spent up to now is 45.0 secs Computing kpt #: 26 total cpu time spent up to now is 47.2 secs Computing kpt #: 27 total cpu time spent up to now is 49.2 secs Computing kpt #: 28 total cpu time spent up to now is 51.4 secs Computing kpt #: 29 total cpu time spent up to now is 53.9 secs Computing kpt #: 30 total cpu time spent up to now is 56.7 secs Computing kpt #: 31 total cpu time spent up to now is 59.1 secs Computing kpt #: 32 total cpu time spent up to now is 61.3 secs Computing kpt #: 33 total cpu time spent up to now is 64.3 secs Computing kpt #: 34 total cpu time spent up to now is 68.4 secs Computing kpt #: 35 total cpu time spent up to now is 71.9 secs Computing kpt #: 36 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 76.3 secs Computing kpt #: 37 total cpu time spent up to now is 79.2 secs Computing kpt #: 38 total cpu time spent up to now is 81.6 secs Computing kpt #: 39 total cpu time spent up to now is 83.9 secs Computing kpt #: 40 total cpu time spent up to now is 86.1 secs Computing kpt #: 41 total cpu time spent up to now is 88.9 secs Computing kpt #: 42 total cpu time spent up to now is 90.5 secs Computing kpt #: 43 total cpu time spent up to now is 92.1 secs Computing kpt #: 44 total cpu time spent up to now is 93.7 secs Computing kpt #: 45 total cpu time spent up to now is 95.3 secs Computing kpt #: 46 total cpu time spent up to now is 96.8 secs Computing kpt #: 47 total cpu time spent up to now is 98.1 secs Computing kpt #: 48 total cpu time spent up to now is 99.6 secs Computing kpt #: 49 total cpu time spent up to now is 101.2 secs Computing kpt #: 50 total cpu time spent up to now is 102.8 secs Computing kpt #: 51 total cpu time spent up to now is 104.5 secs Computing kpt #: 52 total cpu time spent up to now is 106.2 secs Computing kpt #: 53 total cpu time spent up to now is 108.1 secs Computing kpt #: 54 total cpu time spent up to now is 110.0 secs Computing kpt #: 55 total cpu time spent up to now is 111.8 secs Computing kpt #: 56 total cpu time spent up to now is 113.9 secs Computing kpt #: 57 total cpu time spent up to now is 115.9 secs Computing kpt #: 58 total cpu time spent up to now is 117.9 secs Computing kpt #: 59 total cpu time spent up to now is 119.9 secs Computing kpt #: 60 total cpu time spent up to now is 121.8 secs Computing kpt #: 61 total cpu time spent up to now is 123.7 secs Computing kpt #: 62 total cpu time spent up to now is 125.6 secs Computing kpt #: 63 total cpu time spent up to now is 127.4 secs Computing kpt #: 64 total cpu time spent up to now is 129.2 secs Computing kpt #: 65 total cpu time spent up to now is 131.0 secs Computing kpt #: 66 total cpu time spent up to now is 132.8 secs Computing kpt #: 67 total cpu time spent up to now is 134.5 secs Computing kpt #: 68 total cpu time spent up to now is 136.3 secs Computing kpt #: 69 total cpu time spent up to now is 137.9 secs Computing kpt #: 70 total cpu time spent up to now is 139.6 secs Computing kpt #: 71 total cpu time spent up to now is 141.2 secs Computing kpt #: 72 total cpu time spent up to now is 142.8 secs Computing kpt #: 73 total cpu time spent up to now is 144.4 secs Computing kpt #: 74 total cpu time spent up to now is 146.0 secs Computing kpt #: 75 total cpu time spent up to now is 147.6 secs Computing kpt #: 76 total cpu time spent up to now is 149.2 secs Computing kpt #: 77 total cpu time spent up to now is 150.9 secs Computing kpt #: 78 total cpu time spent up to now is 152.6 secs Computing kpt #: 79 total cpu time spent up to now is 154.3 secs Computing kpt #: 80 total cpu time spent up to now is 156.0 secs Computing kpt #: 81 total cpu time spent up to now is 157.6 secs Computing kpt #: 82 total cpu time spent up to now is 159.3 secs Computing kpt #: 83 total cpu time spent up to now is 161.0 secs Computing kpt #: 84 total cpu time spent up to now is 162.8 secs Computing kpt #: 85 total cpu time spent up to now is 164.4 secs Computing kpt #: 86 total cpu time spent up to now is 166.1 secs Computing kpt #: 87 total cpu time spent up to now is 167.7 secs Computing kpt #: 88 total cpu time spent up to now is 169.4 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 172.7 secs Computing kpt #: 91 total cpu time spent up to now is 174.3 secs Computing kpt #: 92 total cpu time spent up to now is 175.9 secs Computing kpt #: 93 total cpu time spent up to now is 177.7 secs Computing kpt #: 94 total cpu time spent up to now is 179.3 secs Computing kpt #: 95 total cpu time spent up to now is 181.0 secs Computing kpt #: 96 total cpu time spent up to now is 182.6 secs Computing kpt #: 97 total cpu time spent up to now is 184.3 secs Computing kpt #: 98 total cpu time spent up to now is 186.0 secs Computing kpt #: 99 total cpu time spent up to now is 187.8 secs Computing kpt #: 100 total cpu time spent up to now is 189.4 secs Computing kpt #: 101 total cpu time spent up to now is 191.1 secs Computing kpt #: 102 total cpu time spent up to now is 192.7 secs Computing kpt #: 103 total cpu time spent up to now is 194.4 secs Computing kpt #: 104 total cpu time spent up to now is 196.1 secs Computing kpt #: 105 total cpu time spent up to now is 197.8 secs Computing kpt #: 106 total cpu time spent up to now is 199.7 secs Computing kpt #: 107 total cpu time spent up to now is 201.4 secs Computing kpt #: 108 total cpu time spent up to now is 203.2 secs Computing kpt #: 109 total cpu time spent up to now is 204.8 secs Computing kpt #: 110 total cpu time spent up to now is 206.5 secs Computing kpt #: 111 total cpu time spent up to now is 208.1 secs Computing kpt #: 112 total cpu time spent up to now is 209.7 secs Computing kpt #: 113 total cpu time spent up to now is 211.4 secs Computing kpt #: 114 total cpu time spent up to now is 213.0 secs Computing kpt #: 115 total cpu time spent up to now is 214.6 secs Computing kpt #: 116 total cpu time spent up to now is 216.1 secs Computing kpt #: 117 total cpu time spent up to now is 217.7 secs Computing kpt #: 118 total cpu time spent up to now is 219.3 secs Computing kpt #: 119 total cpu time spent up to now is 220.8 secs Computing kpt #: 120 total cpu time spent up to now is 222.4 secs Computing kpt #: 121 total cpu time spent up to now is 224.0 secs Computing kpt #: 122 total cpu time spent up to now is 225.6 secs Computing kpt #: 123 total cpu time spent up to now is 227.2 secs Computing kpt #: 124 total cpu time spent up to now is 228.8 secs Computing kpt #: 125 total cpu time spent up to now is 230.5 secs Computing kpt #: 126 total cpu time spent up to now is 232.1 secs Computing kpt #: 127 total cpu time spent up to now is 233.8 secs Computing kpt #: 128 total cpu time spent up to now is 235.4 secs Computing kpt #: 129 total cpu time spent up to now is 237.1 secs Computing kpt #: 130 total cpu time spent up to now is 239.1 secs Computing kpt #: 131 total cpu time spent up to now is 241.1 secs Computing kpt #: 132 total cpu time spent up to now is 243.1 secs Computing kpt #: 133 total cpu time spent up to now is 245.0 secs Computing kpt #: 134 total cpu time spent up to now is 247.0 secs Computing kpt #: 135 total cpu time spent up to now is 248.8 secs Computing kpt #: 136 total cpu time spent up to now is 250.8 secs Computing kpt #: 137 total cpu time spent up to now is 252.8 secs Computing kpt #: 138 total cpu time spent up to now is 255.1 secs Computing kpt #: 139 total cpu time spent up to now is 257.1 secs Computing kpt #: 140 total cpu time spent up to now is 259.2 secs Computing kpt #: 141 total cpu time spent up to now is 261.3 secs Computing kpt #: 142 total cpu time spent up to now is 263.4 secs Computing kpt #: 143 total cpu time spent up to now is 265.3 secs Computing kpt #: 144 total cpu time spent up to now is 267.3 secs Computing kpt #: 145 total cpu time spent up to now is 269.0 secs Computing kpt #: 146 total cpu time spent up to now is 270.8 secs Computing kpt #: 147 total cpu time spent up to now is 272.6 secs Computing kpt #: 148 total cpu time spent up to now is 274.2 secs Computing kpt #: 149 total cpu time spent up to now is 275.6 secs Computing kpt #: 150 total cpu time spent up to now is 277.0 secs Computing kpt #: 151 total cpu time spent up to now is 278.7 secs Computing kpt #: 152 total cpu time spent up to now is 280.3 secs Computing kpt #: 153 total cpu time spent up to now is 282.1 secs Computing kpt #: 154 total cpu time spent up to now is 283.8 secs Computing kpt #: 155 total cpu time spent up to now is 285.4 secs Computing kpt #: 156 total cpu time spent up to now is 287.3 secs Computing kpt #: 157 total cpu time spent up to now is 289.0 secs Computing kpt #: 158 total cpu time spent up to now is 290.8 secs Computing kpt #: 159 total cpu time spent up to now is 292.5 secs Computing kpt #: 160 total cpu time spent up to now is 294.2 secs Computing kpt #: 161 total cpu time spent up to now is 295.9 secs Computing kpt #: 162 total cpu time spent up to now is 297.7 secs Computing kpt #: 163 total cpu time spent up to now is 299.5 secs Computing kpt #: 164 total cpu time spent up to now is 301.2 secs Computing kpt #: 165 total cpu time spent up to now is 303.0 secs Computing kpt #: 166 total cpu time spent up to now is 304.6 secs Computing kpt #: 167 total cpu time spent up to now is 306.3 secs Computing kpt #: 168 total cpu time spent up to now is 307.9 secs Computing kpt #: 169 total cpu time spent up to now is 309.6 secs Computing kpt #: 170 total cpu time spent up to now is 311.1 secs Computing kpt #: 171 total cpu time spent up to now is 312.7 secs Computing kpt #: 172 total cpu time spent up to now is 314.5 secs Computing kpt #: 173 total cpu time spent up to now is 316.2 secs Computing kpt #: 174 total cpu time spent up to now is 317.9 secs Computing kpt #: 175 total cpu time spent up to now is 319.6 secs Computing kpt #: 176 total cpu time spent up to now is 321.4 secs Computing kpt #: 177 total cpu time spent up to now is 323.2 secs Computing kpt #: 178 total cpu time spent up to now is 324.9 secs Computing kpt #: 179 total cpu time spent up to now is 326.7 secs Computing kpt #: 180 total cpu time spent up to now is 328.3 secs Computing kpt #: 181 total cpu time spent up to now is 330.0 secs Computing kpt #: 182 total cpu time spent up to now is 331.7 secs Computing kpt #: 183 total cpu time spent up to now is 333.6 secs Computing kpt #: 184 total cpu time spent up to now is 335.6 secs Computing kpt #: 185 total cpu time spent up to now is 337.7 secs Computing kpt #: 186 total cpu time spent up to now is 339.6 secs Computing kpt #: 187 total cpu time spent up to now is 341.6 secs Computing kpt #: 188 total cpu time spent up to now is 343.4 secs Computing kpt #: 189 total cpu time spent up to now is 345.4 secs Computing kpt #: 190 total cpu time spent up to now is 347.8 secs Computing kpt #: 191 total cpu time spent up to now is 349.9 secs Computing kpt #: 192 total cpu time spent up to now is 352.2 secs Computing kpt #: 193 total cpu time spent up to now is 354.2 secs Computing kpt #: 194 total cpu time spent up to now is 356.6 secs Computing kpt #: 195 total cpu time spent up to now is 359.1 secs Computing kpt #: 196 total cpu time spent up to now is 361.5 secs Computing kpt #: 197 total cpu time spent up to now is 365.1 secs Computing kpt #: 198 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 369.9 secs Computing kpt #: 199 total cpu time spent up to now is 373.6 secs Computing kpt #: 200 total cpu time spent up to now is 376.5 secs Computing kpt #: 201 total cpu time spent up to now is 379.7 secs Computing kpt #: 202 total cpu time spent up to now is 383.4 secs ethr = 1.52E-08, avg # of iterations = 31.0 total cpu time spent up to now is 383.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 12627 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0424 -12.0424 -10.9599 -10.9599 -10.9440 -10.9440 -10.9440 -10.9440 -10.6506 -10.6506 -10.6506 -10.6506 -7.8430 -7.8430 -7.4213 -7.4213 -7.3979 -7.3979 -6.5564 -6.5564 -6.5564 -6.5564 -6.5249 -6.5249 -6.5249 -6.5249 -1.9139 -1.9139 -1.6811 -1.6811 -1.6811 -1.6811 0.2227 0.2227 0.2227 0.2227 0.4217 0.4217 1.3972 1.3972 1.4162 1.4162 1.4162 1.4162 1.4410 1.4410 1.4942 1.4942 1.4942 1.4942 1.7431 1.7431 1.9060 1.9060 1.9060 1.9060 2.2014 2.2014 2.4347 2.4347 2.4347 2.4347 4.9455 4.9455 5.4787 5.4787 5.4787 5.4787 6.9153 6.9153 8.1334 8.1334 8.4138 8.4138 8.4138 8.4138 k = 0.0167-0.0096 0.0136 ( 12599 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0421 -12.0421 -10.9600 -10.9600 -10.9441 -10.9441 -10.9440 -10.9440 -10.6511 -10.6511 -10.6506 -10.6506 -7.8425 -7.8425 -7.4212 -7.4212 -7.3979 -7.3979 -6.5563 -6.5563 -6.5563 -6.5563 -6.5249 -6.5249 -6.5248 -6.5248 -1.9137 -1.9137 -1.6809 -1.6809 -1.6808 -1.6808 0.2226 0.2226 0.2236 0.2236 0.4222 0.4222 1.3849 1.3849 1.4155 1.4155 1.4162 1.4162 1.4466 1.4466 1.4937 1.4937 1.4956 1.4956 1.7425 1.7425 1.9053 1.9053 1.9078 1.9078 2.2007 2.2007 2.4327 2.4327 2.4339 2.4339 4.9470 4.9470 5.4799 5.4799 5.4802 5.4802 6.9191 6.9191 8.1361 8.1361 8.4158 8.4158 8.4170 8.4170 k = 0.0333-0.0192 0.0272 ( 12563 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0413 -12.0413 -10.9602 -10.9602 -10.9444 -10.9444 -10.9441 -10.9441 -10.6525 -10.6525 -10.6505 -10.6505 -7.8410 -7.8410 -7.4210 -7.4210 -7.3977 -7.3977 -6.5560 -6.5560 -6.5559 -6.5559 -6.5248 -6.5248 -6.5246 -6.5246 -1.9131 -1.9131 -1.6802 -1.6802 -1.6798 -1.6798 0.2222 0.2222 0.2263 0.2263 0.4237 0.4237 1.3607 1.3607 1.4086 1.4086 1.4160 1.4160 1.4551 1.4551 1.4921 1.4921 1.5006 1.5006 1.7405 1.7405 1.9032 1.9032 1.9127 1.9127 2.1988 2.1988 2.4269 2.4269 2.4316 2.4316 4.9515 4.9515 5.4836 5.4836 5.4847 5.4847 6.9306 6.9306 8.1445 8.1445 8.4219 8.4219 8.4265 8.4265 k = 0.0500-0.0289 0.0408 ( 12567 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0401 -12.0401 -10.9606 -10.9606 -10.9449 -10.9449 -10.9443 -10.9443 -10.6548 -10.6548 -10.6505 -10.6505 -7.8385 -7.8385 -7.4206 -7.4206 -7.3974 -7.3974 -6.5555 -6.5555 -6.5553 -6.5553 -6.5246 -6.5246 -6.5242 -6.5242 -1.9121 -1.9121 -1.6791 -1.6791 -1.6782 -1.6782 0.2216 0.2216 0.2307 0.2307 0.4264 0.4264 1.3315 1.3315 1.3961 1.3961 1.4157 1.4157 1.4587 1.4587 1.4896 1.4896 1.5098 1.5098 1.7372 1.7372 1.8997 1.8997 1.9205 1.9205 2.1959 2.1959 2.4172 2.4172 2.4280 2.4280 4.9588 4.9588 5.4897 5.4897 5.4923 5.4923 6.9496 6.9496 8.1582 8.1582 8.4320 8.4320 8.4424 8.4424 k = 0.0667-0.0385 0.0544 ( 12551 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0384 -12.0384 -10.9611 -10.9611 -10.9457 -10.9457 -10.9446 -10.9446 -10.6580 -10.6580 -10.6504 -10.6504 -7.8351 -7.8351 -7.4200 -7.4200 -7.3970 -7.3970 -6.5549 -6.5549 -6.5545 -6.5545 -6.5245 -6.5245 -6.5237 -6.5237 -1.9106 -1.9106 -1.6776 -1.6776 -1.6759 -1.6759 0.2204 0.2204 0.2369 0.2369 0.4304 0.4304 1.2987 1.2987 1.3793 1.3793 1.4153 1.4153 1.4570 1.4570 1.4860 1.4860 1.5213 1.5213 1.7325 1.7325 1.8949 1.8949 1.9306 1.9306 2.1922 2.1922 2.4038 2.4038 2.4232 2.4232 4.9688 4.9688 5.4981 5.4981 5.5027 5.5027 6.9760 6.9760 8.1775 8.1775 8.4460 8.4460 8.4645 8.4645 k = 0.0833-0.0481 0.0680 ( 12571 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0362 -12.0362 -10.9617 -10.9617 -10.9465 -10.9465 -10.9450 -10.9450 -10.6621 -10.6621 -10.6502 -10.6502 -7.8309 -7.8309 -7.4192 -7.4192 -7.3965 -7.3965 -6.5541 -6.5541 -6.5534 -6.5534 -6.5242 -6.5242 -6.5231 -6.5231 -1.9088 -1.9088 -1.6756 -1.6756 -1.6729 -1.6729 0.2187 0.2187 0.2447 0.2447 0.4358 0.4358 1.2628 1.2628 1.3590 1.3590 1.4147 1.4147 1.4517 1.4517 1.4816 1.4816 1.5328 1.5328 1.7266 1.7266 1.8890 1.8890 1.9419 1.9419 2.1883 2.1883 2.3868 2.3868 2.4175 2.4175 4.9813 4.9813 5.5087 5.5087 5.5158 5.5158 7.0096 7.0096 8.2021 8.2021 8.4639 8.4639 8.4927 8.4927 k = 0.1000-0.0577 0.0816 ( 12587 PWs) bands (ev): -22.7099 -22.7099 -22.7081 -22.7081 -12.0335 -12.0335 -10.9625 -10.9625 -10.9475 -10.9475 -10.9454 -10.9454 -10.6671 -10.6671 -10.6501 -10.6501 -7.8257 -7.8257 -7.4183 -7.4183 -7.3959 -7.3959 -6.5531 -6.5531 -6.5522 -6.5522 -6.5239 -6.5239 -6.5223 -6.5223 -1.9065 -1.9065 -1.6733 -1.6733 -1.6693 -1.6693 0.2162 0.2162 0.2543 0.2543 0.4429 0.4429 1.2240 1.2240 1.3358 1.3358 1.4141 1.4141 1.4437 1.4437 1.4762 1.4762 1.5431 1.5431 1.7193 1.7193 1.8820 1.8820 1.9530 1.9530 2.1854 2.1854 2.3663 2.3663 2.4113 2.4113 4.9960 4.9960 5.5212 5.5212 5.5316 5.5316 7.0501 7.0501 8.2320 8.2320 8.4856 8.4856 8.5268 8.5268 k = 0.1167-0.0674 0.0953 ( 12567 PWs) bands (ev): -22.7098 -22.7098 -22.7081 -22.7081 -12.0304 -12.0304 -10.9635 -10.9635 -10.9486 -10.9486 -10.9459 -10.9459 -10.6729 -10.6729 -10.6499 -10.6499 -7.8198 -7.8198 -7.4173 -7.4173 -7.3952 -7.3952 -6.5520 -6.5520 -6.5507 -6.5507 -6.5236 -6.5236 -6.5215 -6.5215 -1.9038 -1.9038 -1.6706 -1.6706 -1.6649 -1.6649 0.2128 0.2128 0.2654 0.2654 0.4519 0.4519 1.1827 1.1827 1.3104 1.3104 1.4133 1.4133 1.4337 1.4337 1.4701 1.4701 1.5515 1.5515 1.7108 1.7108 1.8742 1.8742 1.9622 1.9622 2.1849 2.1849 2.3426 2.3426 2.4049 2.4049 5.0127 5.0127 5.5355 5.5355 5.5497 5.5497 7.0972 7.0972 8.2672 8.2672 8.5110 8.5110 8.5667 8.5667 k = 0.1333-0.0770 0.1089 ( 12575 PWs) bands (ev): -22.7098 -22.7098 -22.7081 -22.7081 -12.0269 -12.0269 -10.9646 -10.9646 -10.9498 -10.9498 -10.9465 -10.9465 -10.6795 -10.6795 -10.6497 -10.6497 -7.8132 -7.8132 -7.4162 -7.4162 -7.3944 -7.3944 -6.5508 -6.5508 -6.5491 -6.5491 -6.5232 -6.5232 -6.5205 -6.5205 -1.9008 -1.9008 -1.6676 -1.6676 -1.6598 -1.6598 0.2085 0.2085 0.2781 0.2781 0.4629 0.4629 1.1391 1.1391 1.2831 1.2831 1.4124 1.4124 1.4219 1.4219 1.4632 1.4632 1.5581 1.5581 1.7009 1.7009 1.8657 1.8657 1.9670 1.9670 2.1887 2.1887 2.3158 2.3158 2.3986 2.3986 5.0310 5.0310 5.5514 5.5514 5.5700 5.5700 7.1506 7.1506 8.3074 8.3074 8.5398 8.5398 8.6120 8.6120 k = 0.1500-0.0866 0.1225 ( 12583 PWs) bands (ev): -22.7098 -22.7098 -22.7081 -22.7081 -12.0231 -12.0231 -10.9658 -10.9658 -10.9510 -10.9510 -10.9471 -10.9471 -10.6868 -10.6868 -10.6495 -10.6495 -7.8059 -7.8059 -7.4149 -7.4149 -7.3935 -7.3935 -6.5494 -6.5494 -6.5473 -6.5473 -6.5228 -6.5228 -6.5194 -6.5194 -1.8973 -1.8973 -1.6642 -1.6642 -1.6540 -1.6540 0.2032 0.2032 0.2922 0.2922 0.4760 0.4760 1.0936 1.0936 1.2543 1.2543 1.4086 1.4086 1.4114 1.4114 1.4556 1.4556 1.5627 1.5627 1.6899 1.6899 1.8567 1.8567 1.9654 1.9654 2.1984 2.1984 2.2862 2.2862 2.3930 2.3930 5.0506 5.0506 5.5685 5.5685 5.5922 5.5922 7.2099 7.2099 8.3526 8.3526 8.5719 8.5719 8.6626 8.6626 k = 0.1667-0.0962 0.1361 ( 12567 PWs) bands (ev): -22.7098 -22.7098 -22.7081 -22.7081 -12.0189 -12.0189 -10.9671 -10.9671 -10.9522 -10.9522 -10.9478 -10.9478 -10.6948 -10.6948 -10.6492 -10.6492 -7.7981 -7.7981 -7.4135 -7.4135 -7.3925 -7.3925 -6.5479 -6.5479 -6.5453 -6.5453 -6.5223 -6.5223 -6.5182 -6.5182 -1.8935 -1.8935 -1.6606 -1.6606 -1.6474 -1.6474 0.1969 0.1969 0.3075 0.3075 0.4913 0.4913 1.0466 1.0466 1.2243 1.2243 1.3941 1.3941 1.4102 1.4102 1.4475 1.4475 1.5655 1.5655 1.6777 1.6777 1.8473 1.8473 1.9565 1.9565 2.2144 2.2144 2.2539 2.2539 2.3885 2.3885 5.0712 5.0712 5.5867 5.5867 5.6160 5.6160 7.2747 7.2747 8.4026 8.4026 8.6071 8.6071 8.7182 8.7182 k = 0.1833-0.1058 0.1497 ( 12583 PWs) bands (ev): -22.7097 -22.7097 -22.7082 -22.7082 -12.0144 -12.0144 -10.9685 -10.9685 -10.9534 -10.9534 -10.9485 -10.9485 -10.7034 -10.7034 -10.6490 -10.6490 -7.7898 -7.7898 -7.4121 -7.4121 -7.3914 -7.3914 -6.5464 -6.5464 -6.5433 -6.5433 -6.5218 -6.5218 -6.5169 -6.5169 -1.8893 -1.8893 -1.6567 -1.6567 -1.6401 -1.6401 0.1898 0.1898 0.3238 0.3238 0.5087 0.5087 0.9987 0.9987 1.1934 1.1934 1.3785 1.3785 1.4088 1.4088 1.4391 1.4391 1.5666 1.5666 1.6644 1.6644 1.8377 1.8377 1.9405 1.9405 2.2193 2.2193 2.2357 2.2357 2.3858 2.3858 5.0924 5.0924 5.6056 5.6056 5.6411 5.6411 7.3448 7.3448 8.4572 8.4572 8.6451 8.6451 8.7783 8.7783 k = 0.2000-0.1155 0.1633 ( 12575 PWs) bands (ev): -22.7097 -22.7097 -22.7082 -22.7082 -12.0096 -12.0096 -10.9699 -10.9699 -10.9545 -10.9545 -10.9492 -10.9492 -10.7126 -10.7126 -10.6487 -10.6487 -7.7812 -7.7812 -7.4106 -7.4106 -7.3902 -7.3902 -6.5447 -6.5447 -6.5411 -6.5411 -6.5213 -6.5213 -6.5156 -6.5156 -1.8848 -1.8848 -1.6526 -1.6526 -1.6321 -1.6321 0.1818 0.1818 0.3408 0.3408 0.5283 0.5283 0.9506 0.9506 1.1620 1.1620 1.3620 1.3620 1.4070 1.4070 1.4305 1.4305 1.5663 1.5663 1.6501 1.6501 1.8279 1.8279 1.9186 1.9186 2.1827 2.1827 2.2599 2.2599 2.3861 2.3861 5.1140 5.1140 5.6251 5.6251 5.6672 5.6672 7.4196 7.4196 8.5163 8.5163 8.6856 8.6856 8.8426 8.8426 k = 0.2167-0.1251 0.1769 ( 12611 PWs) bands (ev): -22.7097 -22.7097 -22.7082 -22.7082 -12.0047 -12.0047 -10.9713 -10.9713 -10.9556 -10.9556 -10.9500 -10.9500 -10.7222 -10.7222 -10.6485 -10.6485 -7.7723 -7.7723 -7.4090 -7.4090 -7.3890 -7.3890 -6.5430 -6.5430 -6.5388 -6.5388 -6.5208 -6.5208 -6.5142 -6.5142 -1.8800 -1.8800 -1.6484 -1.6484 -1.6233 -1.6233 0.1732 0.1732 0.3581 0.3581 0.5499 0.5499 0.9030 0.9030 1.1302 1.1302 1.3448 1.3448 1.4046 1.4046 1.4222 1.4222 1.5646 1.5646 1.6350 1.6350 1.8181 1.8181 1.8919 1.8919 2.1443 2.1443 2.2833 2.2833 2.3917 2.3917 5.1357 5.1357 5.6449 5.6449 5.6940 5.6940 7.4989 7.4989 8.5796 8.5796 8.7282 8.7282 8.9107 8.9107 k = 0.2333-0.1347 0.1905 ( 12603 PWs) bands (ev): -22.7096 -22.7096 -22.7083 -22.7083 -11.9996 -11.9996 -10.9727 -10.9727 -10.9566 -10.9566 -10.9507 -10.9507 -10.7323 -10.7323 -10.6482 -10.6482 -7.7633 -7.7633 -7.4074 -7.4074 -7.3877 -7.3877 -6.5413 -6.5413 -6.5365 -6.5365 -6.5203 -6.5203 -6.5128 -6.5128 -1.8750 -1.8750 -1.6440 -1.6440 -1.6138 -1.6138 0.1641 0.1641 0.3749 0.3749 0.5735 0.5735 0.8570 0.8570 1.0985 1.0985 1.3271 1.3271 1.4005 1.4005 1.4153 1.4153 1.5618 1.5618 1.6192 1.6192 1.8083 1.8083 1.8616 1.8616 2.1045 2.1045 2.3016 2.3016 2.4057 2.4057 5.1572 5.1572 5.6647 5.6647 5.7211 5.7211 7.5821 7.5821 8.6469 8.6469 8.7725 8.7725 8.9821 8.9821 k = 0.2500-0.1443 0.2041 ( 12615 PWs) bands (ev): -22.7096 -22.7096 -22.7083 -22.7083 -11.9943 -11.9943 -10.9739 -10.9739 -10.9576 -10.9576 -10.9515 -10.9515 -10.7427 -10.7427 -10.6479 -10.6479 -7.7542 -7.7542 -7.4058 -7.4058 -7.3864 -7.3864 -6.5395 -6.5395 -6.5342 -6.5342 -6.5197 -6.5197 -6.5113 -6.5113 -1.8698 -1.8698 -1.6395 -1.6395 -1.6037 -1.6037 0.1546 0.1546 0.3902 0.3902 0.5991 0.5991 0.8141 0.8141 1.0669 1.0669 1.3091 1.3091 1.3941 1.3941 1.4105 1.4105 1.5578 1.5578 1.6029 1.6029 1.7985 1.7985 1.8285 1.8285 2.0636 2.0636 2.3126 2.3126 2.4296 2.4296 5.1783 5.1783 5.6843 5.6843 5.7482 5.7482 7.6689 7.6689 8.7180 8.7180 8.8180 8.8180 9.0563 9.0563 k = 0.2667-0.1540 0.2177 ( 12611 PWs) bands (ev): -22.7095 -22.7095 -22.7083 -22.7083 -11.9891 -11.9891 -10.9750 -10.9750 -10.9584 -10.9584 -10.9523 -10.9523 -10.7534 -10.7534 -10.6476 -10.6476 -7.7452 -7.7452 -7.4041 -7.4041 -7.3850 -7.3850 -6.5377 -6.5377 -6.5319 -6.5319 -6.5192 -6.5192 -6.5099 -6.5099 -1.8644 -1.8644 -1.6350 -1.6350 -1.5930 -1.5930 0.1449 0.1449 0.4024 0.4024 0.6264 0.6264 0.7762 0.7762 1.0359 1.0359 1.2911 1.2911 1.3858 1.3858 1.4076 1.4076 1.5527 1.5527 1.5862 1.5862 1.7885 1.7885 1.7935 1.7935 2.0222 2.0222 2.3176 2.3176 2.4609 2.4609 5.1988 5.1988 5.7035 5.7035 5.7751 5.7751 7.7588 7.7588 8.7925 8.7925 8.8641 8.8641 9.1326 9.1326 k = 0.2833-0.1636 0.2313 ( 12615 PWs) bands (ev): -22.7095 -22.7095 -22.7084 -22.7084 -11.9838 -11.9838 -10.9759 -10.9759 -10.9593 -10.9593 -10.9531 -10.9531 -10.7642 -10.7642 -10.6473 -10.6473 -7.7363 -7.7363 -7.4025 -7.4025 -7.3836 -7.3836 -6.5360 -6.5360 -6.5296 -6.5296 -6.5187 -6.5187 -6.5084 -6.5084 -1.8590 -1.8590 -1.6306 -1.6306 -1.5818 -1.5818 0.1352 0.1352 0.4092 0.4092 0.6555 0.6555 0.7460 0.7460 1.0058 1.0058 1.2731 1.2731 1.3767 1.3767 1.4054 1.4054 1.5462 1.5462 1.5694 1.5694 1.7574 1.7574 1.7783 1.7783 1.9807 1.9807 2.3192 2.3192 2.4965 2.4965 5.2184 5.2184 5.7221 5.7221 5.8013 5.8013 7.8515 7.8515 8.8702 8.8702 8.9101 8.9101 9.2104 9.2104 k = 0.3000-0.1732 0.2449 ( 12623 PWs) bands (ev): -22.7095 -22.7095 -22.7084 -22.7084 -11.9786 -11.9786 -10.9765 -10.9765 -10.9600 -10.9600 -10.9539 -10.9539 -10.7751 -10.7751 -10.6471 -10.6471 -7.7277 -7.7277 -7.4009 -7.4009 -7.3822 -7.3822 -6.5343 -6.5343 -6.5273 -6.5273 -6.5181 -6.5181 -6.5070 -6.5070 -1.8536 -1.8536 -1.6261 -1.6261 -1.5702 -1.5702 0.1255 0.1255 0.4084 0.4084 0.6862 0.6862 0.7261 0.7261 0.9767 0.9767 1.2554 1.2554 1.3674 1.3674 1.4035 1.4035 1.5380 1.5380 1.5525 1.5525 1.7213 1.7213 1.7673 1.7673 1.9399 1.9399 2.3192 2.3192 2.5338 2.5338 5.2371 5.2371 5.7399 5.7399 5.8268 5.8268 7.9463 7.9463 8.9506 8.9506 8.9552 8.9552 9.2888 9.2888 k = 0.3167-0.1828 0.2586 ( 12615 PWs) bands (ev): -22.7094 -22.7094 -22.7084 -22.7084 -11.9735 -11.9735 -10.9769 -10.9769 -10.9606 -10.9606 -10.9546 -10.9546 -10.7860 -10.7860 -10.6468 -10.6468 -7.7194 -7.7194 -7.3994 -7.3994 -7.3808 -7.3808 -6.5327 -6.5327 -6.5251 -6.5251 -6.5176 -6.5176 -6.5056 -6.5056 -1.8482 -1.8482 -1.6219 -1.6219 -1.5583 -1.5583 0.1161 0.1161 0.3982 0.3982 0.7182 0.7182 0.7185 0.7185 0.9490 0.9490 1.2382 1.2382 1.3581 1.3581 1.4017 1.4017 1.5272 1.5272 1.5358 1.5358 1.6865 1.6865 1.7548 1.7548 1.9009 1.9009 2.3184 2.3184 2.5714 2.5714 5.2547 5.2547 5.7568 5.7568 5.8512 5.8512 8.0427 8.0427 8.9985 8.9985 9.0333 9.0333 9.3628 9.3628 k = 0.3333-0.1925 0.2722 ( 12623 PWs) bands (ev): -22.7094 -22.7094 -22.7084 -22.7084 -11.9686 -11.9686 -10.9771 -10.9771 -10.9611 -10.9611 -10.9553 -10.9553 -10.7968 -10.7968 -10.6465 -10.6465 -7.7115 -7.7115 -7.3980 -7.3980 -7.3794 -7.3794 -6.5311 -6.5311 -6.5230 -6.5230 -6.5171 -6.5171 -6.5043 -6.5043 -1.8430 -1.8430 -1.6177 -1.6177 -1.5463 -1.5463 0.1071 0.1071 0.3795 0.3795 0.7228 0.7228 0.7516 0.7516 0.9230 0.9230 1.2215 1.2215 1.3489 1.3489 1.4000 1.4000 1.5125 1.5125 1.5193 1.5193 1.6547 1.6547 1.7399 1.7399 1.8654 1.8654 2.3173 2.3173 2.6084 2.6084 5.2711 5.2711 5.7726 5.7726 5.8742 5.8742 8.1403 8.1403 9.0389 9.0389 9.1178 9.1178 9.4089 9.4089 k = 0.3500-0.2021 0.2858 ( 12603 PWs) bands (ev): -22.7094 -22.7094 -22.7085 -22.7085 -11.9639 -11.9639 -10.9770 -10.9770 -10.9615 -10.9615 -10.9560 -10.9560 -10.8073 -10.8073 -10.6463 -10.6463 -7.7042 -7.7042 -7.3966 -7.3966 -7.3781 -7.3781 -6.5296 -6.5296 -6.5211 -6.5211 -6.5167 -6.5167 -6.5030 -6.5030 -1.8380 -1.8380 -1.6139 -1.6139 -1.5344 -1.5344 0.0985 0.0985 0.3546 0.3546 0.7369 0.7369 0.7861 0.7861 0.8988 0.8988 1.2054 1.2054 1.3398 1.3398 1.3983 1.3983 1.4925 1.4925 1.5032 1.5032 1.6280 1.6280 1.7209 1.7209 1.8353 1.8353 2.3161 2.3161 2.6439 2.6439 5.2862 5.2862 5.7872 5.7872 5.8958 5.8958 8.2383 8.2383 9.0753 9.0753 9.2032 9.2032 9.4538 9.4538 k = 0.3667-0.2117 0.2994 ( 12599 PWs) bands (ev): -22.7093 -22.7093 -22.7085 -22.7085 -11.9596 -11.9596 -10.9766 -10.9766 -10.9616 -10.9616 -10.9566 -10.9566 -10.8174 -10.8174 -10.6461 -10.6461 -7.6974 -7.6974 -7.3953 -7.3953 -7.3768 -7.3768 -6.5282 -6.5282 -6.5192 -6.5192 -6.5163 -6.5163 -6.5019 -6.5019 -1.8334 -1.8334 -1.6102 -1.6102 -1.5227 -1.5227 0.0905 0.0905 0.3265 0.3265 0.7581 0.7581 0.8214 0.8214 0.8769 0.8769 1.1900 1.1900 1.3308 1.3308 1.3966 1.3966 1.4664 1.4664 1.4874 1.4874 1.6075 1.6075 1.6970 1.6970 1.8122 1.8122 2.3148 2.3148 2.6773 2.6773 5.2998 5.2998 5.8005 5.8005 5.9156 5.9156 8.3360 8.3360 9.1064 9.1064 9.2886 9.2886 9.5003 9.5003 k = 0.3833-0.2213 0.3130 ( 12595 PWs) bands (ev): -22.7093 -22.7093 -22.7085 -22.7085 -11.9556 -11.9556 -10.9761 -10.9761 -10.9616 -10.9616 -10.9571 -10.9571 -10.8271 -10.8271 -10.6459 -10.6459 -7.6913 -7.6913 -7.3942 -7.3942 -7.3756 -7.3756 -6.5270 -6.5270 -6.5176 -6.5176 -6.5159 -6.5159 -6.5008 -6.5008 -1.8290 -1.8290 -1.6069 -1.6069 -1.5115 -1.5115 0.0832 0.0832 0.2977 0.2977 0.7836 0.7836 0.8573 0.8573 0.8579 0.8579 1.1753 1.1753 1.3217 1.3217 1.3949 1.3949 1.4354 1.4354 1.4719 1.4719 1.5928 1.5928 1.6695 1.6695 1.7956 1.7956 2.3136 2.3136 2.7080 2.7080 5.3120 5.3120 5.8124 5.8124 5.9336 5.9336 8.4326 8.4326 9.1308 9.1308 9.3723 9.3723 9.5489 9.5489 k = 0.4000-0.2309 0.3266 ( 12575 PWs) bands (ev): -22.7093 -22.7093 -22.7085 -22.7085 -11.9520 -11.9520 -10.9755 -10.9755 -10.9613 -10.9613 -10.9576 -10.9576 -10.8361 -10.8361 -10.6457 -10.6457 -7.6859 -7.6859 -7.3931 -7.3931 -7.3745 -7.3745 -6.5259 -6.5259 -6.5162 -6.5162 -6.5155 -6.5155 -6.4998 -6.4998 -1.8251 -1.8251 -1.6039 -1.6039 -1.5011 -1.5011 0.0767 0.0767 0.2700 0.2700 0.8088 0.8088 0.8450 0.8450 0.8933 0.8933 1.1611 1.1611 1.3122 1.3122 1.3932 1.3932 1.4014 1.4014 1.4566 1.4566 1.5824 1.5824 1.6408 1.6408 1.7840 1.7840 2.3126 2.3126 2.7357 2.7357 5.3226 5.3226 5.8229 5.8229 5.9495 5.9495 8.5272 8.5272 9.1472 9.1472 9.4520 9.4520 9.6006 9.6006 k = 0.4167-0.2406 0.3402 ( 12599 PWs) bands (ev): -22.7093 -22.7093 -22.7085 -22.7085 -11.9489 -11.9489 -10.9749 -10.9749 -10.9608 -10.9608 -10.9580 -10.9580 -10.8443 -10.8443 -10.6456 -10.6456 -7.6813 -7.6813 -7.3923 -7.3923 -7.3735 -7.3735 -6.5249 -6.5249 -6.5154 -6.5154 -6.5147 -6.5147 -6.4990 -6.4990 -1.8217 -1.8217 -1.6013 -1.6013 -1.4917 -1.4917 0.0711 0.0711 0.2447 0.2447 0.8147 0.8147 0.8562 0.8562 0.9289 0.9289 1.1472 1.1472 1.3022 1.3022 1.3668 1.3668 1.3915 1.3915 1.4418 1.4418 1.5752 1.5752 1.6136 1.6136 1.7758 1.7758 2.3116 2.3116 2.7598 2.7598 5.3317 5.3317 5.8318 5.8318 5.9633 5.9633 8.6187 8.6187 9.1544 9.1544 9.5239 9.5239 9.6572 9.6572 k = 0.4333-0.2502 0.3538 ( 12591 PWs) bands (ev): -22.7093 -22.7093 -22.7086 -22.7086 -11.9462 -11.9462 -10.9744 -10.9744 -10.9601 -10.9601 -10.9584 -10.9584 -10.8514 -10.8514 -10.6454 -10.6454 -7.6774 -7.6774 -7.3915 -7.3915 -7.3727 -7.3727 -6.5241 -6.5241 -6.5151 -6.5151 -6.5137 -6.5137 -6.4983 -6.4983 -1.8189 -1.8189 -1.5992 -1.5992 -1.4836 -1.4836 0.0664 0.0664 0.2228 0.2228 0.8056 0.8056 0.8862 0.8862 0.9632 0.9632 1.1328 1.1328 1.2912 1.2912 1.3337 1.3337 1.3900 1.3900 1.4277 1.4277 1.5700 1.5700 1.5900 1.5900 1.7699 1.7699 2.3109 2.3109 2.7800 2.7800 5.3392 5.3392 5.8392 5.8392 5.9747 5.9747 8.7057 8.7057 9.1515 9.1515 9.5839 9.5839 9.7206 9.7206 k = 0.4500-0.2598 0.3674 ( 12599 PWs) bands (ev): -22.7093 -22.7093 -22.7086 -22.7086 -11.9442 -11.9442 -10.9740 -10.9740 -10.9592 -10.9592 -10.9587 -10.9587 -10.8574 -10.8574 -10.6453 -10.6453 -7.6744 -7.6744 -7.3909 -7.3909 -7.3720 -7.3720 -6.5235 -6.5235 -6.5149 -6.5149 -6.5128 -6.5128 -6.4978 -6.4978 -1.8166 -1.8166 -1.5975 -1.5975 -1.4770 -1.4770 0.0627 0.0627 0.2051 0.2051 0.7966 0.7966 0.9187 0.9187 0.9949 0.9949 1.1175 1.1175 1.2791 1.2791 1.3045 1.3045 1.3887 1.3887 1.4151 1.4151 1.5663 1.5663 1.5712 1.5712 1.7657 1.7657 2.3102 2.3102 2.7961 2.7961 5.3450 5.3450 5.8449 5.8449 5.9837 5.9837 8.7865 8.7865 9.1383 9.1383 9.6301 9.6301 9.7898 9.7898 k = 0.4667-0.2694 0.3810 ( 12606 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9427 -11.9427 -10.9737 -10.9737 -10.9589 -10.9589 -10.9584 -10.9584 -10.8618 -10.8618 -10.6453 -10.6453 -7.6722 -7.6722 -7.3905 -7.3905 -7.3715 -7.3715 -6.5230 -6.5230 -6.5147 -6.5147 -6.5122 -6.5122 -6.4974 -6.4974 -1.8149 -1.8149 -1.5962 -1.5962 -1.4721 -1.4721 0.0600 0.0600 0.1921 0.1921 0.7898 0.7898 0.9499 0.9499 1.0218 1.0218 1.1008 1.1008 1.2670 1.2670 1.2815 1.2815 1.3877 1.3877 1.4051 1.4051 1.5579 1.5579 1.5639 1.5639 1.7629 1.7629 2.3098 2.3098 2.8077 2.8077 5.3492 5.3492 5.8491 5.8491 5.9903 5.9903 8.8585 8.8585 9.1158 9.1158 9.6629 9.6629 9.8607 9.8607 k = 0.4833-0.2791 0.3946 ( 12606 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9417 -11.9417 -10.9735 -10.9735 -10.9590 -10.9590 -10.9578 -10.9578 -10.8646 -10.8646 -10.6452 -10.6452 -7.6709 -7.6709 -7.3903 -7.3903 -7.3712 -7.3712 -6.5228 -6.5228 -6.5146 -6.5146 -6.5119 -6.5119 -6.4971 -6.4971 -1.8139 -1.8139 -1.5955 -1.5955 -1.4691 -1.4691 0.0583 0.0583 0.1841 0.1841 0.7856 0.7856 0.9756 0.9756 1.0406 1.0406 1.0848 1.0848 1.2572 1.2572 1.2668 1.2668 1.3872 1.3872 1.3987 1.3987 1.5499 1.5499 1.5625 1.5625 1.7612 1.7612 2.3095 2.3095 2.8148 2.8148 5.3517 5.3517 5.8515 5.8515 5.9942 5.9942 8.9157 8.9157 9.0888 9.0888 9.6827 9.6827 9.9152 9.9152 k = 0.5000-0.2887 0.4082 ( 12558 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9414 -11.9414 -10.9735 -10.9735 -10.9590 -10.9590 -10.9576 -10.9576 -10.8656 -10.8656 -10.6452 -10.6452 -7.6705 -7.6705 -7.3902 -7.3902 -7.3711 -7.3711 -6.5227 -6.5227 -6.5146 -6.5146 -6.5117 -6.5117 -6.4970 -6.4970 -1.8136 -1.8136 -1.5952 -1.5952 -1.4681 -1.4681 0.0578 0.0578 0.1814 0.1814 0.7842 0.7842 0.9868 0.9868 1.0475 1.0475 1.0770 1.0770 1.2533 1.2533 1.2618 1.2618 1.3870 1.3870 1.3965 1.3965 1.5473 1.5473 1.5620 1.5620 1.7607 1.7607 2.3095 2.3095 2.8172 2.8172 5.3525 5.3525 5.8524 5.8524 5.9955 5.9955 8.9411 8.9411 9.0736 9.0736 9.6894 9.6894 9.9219 9.9219 k = 0.5000-0.2887 0.4082 ( 12558 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9414 -11.9414 -10.9735 -10.9735 -10.9590 -10.9590 -10.9576 -10.9576 -10.8656 -10.8656 -10.6452 -10.6452 -7.6705 -7.6705 -7.3902 -7.3902 -7.3711 -7.3711 -6.5227 -6.5227 -6.5146 -6.5146 -6.5117 -6.5117 -6.4970 -6.4970 -1.8136 -1.8136 -1.5952 -1.5952 -1.4681 -1.4681 0.0578 0.0578 0.1814 0.1814 0.7842 0.7842 0.9868 0.9868 1.0475 1.0475 1.0770 1.0770 1.2533 1.2533 1.2618 1.2618 1.3870 1.3870 1.3965 1.3965 1.5473 1.5473 1.5620 1.5620 1.7607 1.7607 2.3095 2.3095 2.8172 2.8172 5.3525 5.3525 5.8524 5.8524 5.9955 5.9955 8.9411 8.9411 9.0736 9.0736 9.6894 9.6894 9.9219 9.9219 k = 0.5000-0.2694 0.4219 ( 12606 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9414 -11.9414 -10.9739 -10.9739 -10.9597 -10.9597 -10.9577 -10.9577 -10.8640 -10.8640 -10.6455 -10.6455 -7.6705 -7.6705 -7.3901 -7.3901 -7.3712 -7.3712 -6.5226 -6.5226 -6.5146 -6.5146 -6.5117 -6.5117 -6.4971 -6.4971 -1.8137 -1.8137 -1.5952 -1.5952 -1.4685 -1.4685 0.0590 0.0590 0.1834 0.1834 0.7797 0.7797 0.9878 0.9878 1.0480 1.0480 1.0766 1.0766 1.2490 1.2490 1.2642 1.2642 1.3708 1.3708 1.4151 1.4151 1.5472 1.5472 1.5638 1.5638 1.7602 1.7602 2.3080 2.3080 2.8172 2.8172 5.3527 5.3527 5.8525 5.8525 5.9952 5.9952 8.9428 8.9428 9.0761 9.0761 9.6899 9.6899 9.9226 9.9226 k = 0.5000-0.2502 0.4355 ( 12618 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9413 -11.9413 -10.9753 -10.9753 -10.9616 -10.9616 -10.9578 -10.9578 -10.8596 -10.8596 -10.6465 -10.6465 -7.6706 -7.6706 -7.3901 -7.3901 -7.3712 -7.3712 -6.5224 -6.5224 -6.5146 -6.5146 -6.5117 -6.5117 -6.4973 -6.4973 -1.8140 -1.8140 -1.5951 -1.5951 -1.4696 -1.4696 0.0625 0.0625 0.1893 0.1893 0.7669 0.7669 0.9899 0.9899 1.0494 1.0494 1.0757 1.0757 1.2419 1.2419 1.2657 1.2657 1.3546 1.3546 1.4391 1.4391 1.5462 1.5462 1.5698 1.5698 1.7588 1.7588 2.3037 2.3037 2.8172 2.8172 5.3533 5.3533 5.8528 5.8528 5.9943 5.9943 8.9481 8.9481 9.0836 9.0836 9.6915 9.6915 9.9246 9.9246 k = 0.5000-0.2309 0.4491 ( 12614 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9412 -11.9412 -10.9782 -10.9782 -10.9638 -10.9638 -10.9579 -10.9579 -10.8529 -10.8529 -10.6482 -10.6482 -7.6708 -7.6708 -7.3899 -7.3899 -7.3713 -7.3713 -6.5222 -6.5222 -6.5146 -6.5146 -6.5117 -6.5117 -6.4975 -6.4975 -1.8144 -1.8144 -1.5948 -1.5948 -1.4714 -1.4714 0.0684 0.0684 0.1989 0.1989 0.7474 0.7474 0.9907 0.9907 1.0520 1.0520 1.0744 1.0744 1.2353 1.2353 1.2627 1.2627 1.3432 1.3432 1.4632 1.4632 1.5438 1.5438 1.5808 1.5808 1.7565 1.7565 2.2965 2.2965 2.8172 2.8172 5.3541 5.3541 5.8534 5.8534 5.9927 5.9927 8.9568 8.9568 9.0960 9.0960 9.6936 9.6936 9.9280 9.9280 k = 0.5000-0.2117 0.4627 ( 12608 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9410 -11.9410 -10.9827 -10.9827 -10.9653 -10.9653 -10.9579 -10.9579 -10.8446 -10.8446 -10.6506 -10.6506 -7.6710 -7.6710 -7.3897 -7.3897 -7.3713 -7.3713 -6.5218 -6.5218 -6.5146 -6.5146 -6.5117 -6.5117 -6.4979 -6.4979 -1.8150 -1.8150 -1.5944 -1.5944 -1.4738 -1.4738 0.0766 0.0766 0.2120 0.2120 0.7231 0.7231 0.9881 0.9881 1.0554 1.0554 1.0734 1.0734 1.2306 1.2306 1.2552 1.2552 1.3369 1.3369 1.4862 1.4862 1.5400 1.5400 1.5970 1.5970 1.7539 1.7539 2.2865 2.2865 2.8173 2.8173 5.3553 5.3553 5.8543 5.8543 5.9906 5.9906 8.9690 8.9690 9.1133 9.1133 9.6951 9.6951 9.9328 9.9334 k = 0.5000-0.1925 0.4763 ( 12600 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9408 -11.9408 -10.9883 -10.9883 -10.9663 -10.9663 -10.9579 -10.9579 -10.8352 -10.8352 -10.6536 -10.6536 -7.6713 -7.6713 -7.3895 -7.3895 -7.3715 -7.3715 -6.5213 -6.5213 -6.5146 -6.5146 -6.5117 -6.5117 -6.4984 -6.4984 -1.8157 -1.8157 -1.5939 -1.5939 -1.4768 -1.4768 0.0871 0.0871 0.2283 0.2283 0.6954 0.6954 0.9808 0.9808 1.0582 1.0582 1.0736 1.0736 1.2285 1.2285 1.2452 1.2452 1.3342 1.3342 1.5067 1.5067 1.5350 1.5350 1.6177 1.6177 1.7514 1.7514 2.2736 2.2736 2.8174 2.8174 5.3567 5.3567 5.8555 5.8555 5.9879 5.9879 8.9848 8.9848 9.1352 9.1352 9.6942 9.6942 9.9262 9.9263 k = 0.5000-0.1732 0.4899 ( 12604 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9406 -11.9406 -10.9943 -10.9943 -10.9668 -10.9668 -10.9579 -10.9579 -10.8251 -10.8251 -10.6572 -10.6572 -7.6716 -7.6716 -7.3892 -7.3892 -7.3716 -7.3716 -6.5208 -6.5208 -6.5146 -6.5146 -6.5116 -6.5116 -6.4989 -6.4989 -1.8165 -1.8165 -1.5932 -1.5932 -1.4803 -1.4803 0.0997 0.0997 0.2472 0.2472 0.6658 0.6658 0.9683 0.9683 1.0592 1.0592 1.0755 1.0755 1.2277 1.2277 1.2366 1.2366 1.3335 1.3335 1.5218 1.5218 1.5317 1.5317 1.6412 1.6412 1.7504 1.7504 2.2580 2.2580 2.8175 2.8175 5.3582 5.3582 5.8570 5.8570 5.9847 5.9847 9.0041 9.0041 9.1615 9.1615 9.6884 9.6884 9.9139 9.9139 k = 0.5000-0.1540 0.5035 ( 12592 PWs) bands (ev): -22.7091 -22.7091 -22.7087 -22.7087 -11.9403 -11.9403 -11.0004 -11.0004 -10.9671 -10.9671 -10.9579 -10.9579 -10.8146 -10.8146 -10.6614 -10.6614 -7.6719 -7.6719 -7.3889 -7.3889 -7.3717 -7.3717 -6.5201 -6.5201 -6.5146 -6.5146 -6.5115 -6.5115 -6.4996 -6.4996 -1.8174 -1.8174 -1.5922 -1.5922 -1.4840 -1.4840 0.1145 0.1145 0.2680 0.2680 0.6355 0.6355 0.9509 0.9509 1.0589 1.0589 1.0782 1.0782 1.2202 1.2202 1.2389 1.2389 1.3336 1.3336 1.5183 1.5183 1.5435 1.5435 1.6635 1.6635 1.7539 1.7539 2.2397 2.2397 2.8177 2.8177 5.3598 5.3598 5.8590 5.8590 5.9811 5.9811 9.0270 9.0270 9.1920 9.1920 9.6747 9.6747 9.9048 9.9048 k = 0.5000-0.1347 0.5171 ( 12588 PWs) bands (ev): -22.7091 -22.7091 -22.7087 -22.7087 -11.9400 -11.9400 -11.0062 -11.0062 -10.9673 -10.9673 -10.9579 -10.9579 -10.8039 -10.8039 -10.6662 -10.6662 -7.6722 -7.6722 -7.3886 -7.3886 -7.3719 -7.3719 -6.5195 -6.5195 -6.5146 -6.5146 -6.5114 -6.5114 -6.5003 -6.5003 -1.8184 -1.8184 -1.5911 -1.5911 -1.4880 -1.4880 0.1314 0.1314 0.2896 0.2896 0.6056 0.6056 0.9294 0.9294 1.0582 1.0582 1.0807 1.0807 1.2110 1.2110 1.2475 1.2475 1.3339 1.3339 1.5095 1.5095 1.5577 1.5577 1.6786 1.6786 1.7668 1.7668 2.2189 2.2189 2.8178 2.8178 5.3614 5.3614 5.8612 5.8612 5.9771 5.9771 9.0534 9.0534 9.2263 9.2263 9.6510 9.6510 9.9016 9.9016 k = 0.5000-0.1155 0.5307 ( 12594 PWs) bands (ev): -22.7091 -22.7091 -22.7087 -22.7087 -11.9398 -11.9398 -11.0115 -11.0115 -10.9675 -10.9675 -10.9579 -10.9579 -10.7934 -10.7934 -10.6715 -10.6715 -7.6726 -7.6726 -7.3883 -7.3883 -7.3720 -7.3720 -6.5188 -6.5188 -6.5147 -6.5147 -6.5113 -6.5113 -6.5011 -6.5011 -1.8193 -1.8193 -1.5899 -1.5899 -1.4920 -1.4920 0.1501 0.1501 0.3105 0.3105 0.5777 0.5777 0.9047 0.9047 1.0575 1.0575 1.0825 1.0825 1.2027 1.2027 1.2590 1.2590 1.3342 1.3342 1.4994 1.4994 1.5711 1.5711 1.6836 1.6836 1.7911 1.7911 2.1955 2.1955 2.8180 2.8180 5.3630 5.3630 5.8638 5.8638 5.9729 5.9729 9.0833 9.0833 9.2641 9.2641 9.6176 9.6176 9.9047 9.9047 k = 0.5000-0.0962 0.5443 ( 12580 PWs) bands (ev): -22.7091 -22.7091 -22.7087 -22.7087 -11.9395 -11.9395 -11.0162 -11.0162 -10.9676 -10.9676 -10.9580 -10.9580 -10.7830 -10.7830 -10.6772 -10.6772 -7.6729 -7.6729 -7.3880 -7.3880 -7.3722 -7.3722 -6.5181 -6.5181 -6.5147 -6.5147 -6.5112 -6.5112 -6.5018 -6.5018 -1.8203 -1.8203 -1.5885 -1.5885 -1.4959 -1.4959 0.1706 0.1706 0.3283 0.3283 0.5538 0.5538 0.8780 0.8780 1.0569 1.0569 1.0838 1.0838 1.1958 1.1958 1.2722 1.2722 1.3345 1.3345 1.4884 1.4884 1.5837 1.5837 1.6817 1.6817 1.8230 1.8230 2.1698 2.1698 2.8182 2.8182 5.3644 5.3644 5.8666 5.8666 5.9687 5.9687 9.1166 9.1166 9.3049 9.3049 9.5764 9.5764 9.8706 9.8706 k = 0.5000-0.0770 0.5579 ( 12588 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9393 -11.9393 -11.0202 -11.0202 -10.9676 -10.9676 -10.9580 -10.9580 -10.7732 -10.7732 -10.6831 -10.6831 -7.6731 -7.6731 -7.3877 -7.3877 -7.3723 -7.3723 -6.5174 -6.5174 -6.5147 -6.5147 -6.5109 -6.5109 -6.5026 -6.5026 -1.8211 -1.8211 -1.5872 -1.5872 -1.4994 -1.4994 0.1927 0.1927 0.3396 0.3396 0.5368 0.5368 0.8509 0.8509 1.0565 1.0565 1.0847 1.0847 1.1902 1.1902 1.2862 1.2862 1.3347 1.3347 1.4770 1.4770 1.5955 1.5955 1.6762 1.6762 1.8583 1.8583 2.1420 2.1420 2.8183 2.8183 5.3656 5.3656 5.8695 5.8695 5.9646 5.9646 9.1533 9.1533 9.3480 9.3480 9.5299 9.5299 9.8169 9.8169 k = 0.5000-0.0577 0.5715 ( 12592 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9392 -11.9392 -11.0233 -11.0233 -10.9677 -10.9677 -10.9580 -10.9580 -10.7642 -10.7642 -10.6891 -10.6891 -7.6734 -7.6734 -7.3875 -7.3875 -7.3724 -7.3724 -6.5168 -6.5168 -6.5148 -6.5148 -6.5107 -6.5107 -6.5034 -6.5034 -1.8218 -1.8218 -1.5859 -1.5859 -1.5025 -1.5025 0.2159 0.2159 0.3411 0.3411 0.5289 0.5289 0.8252 0.8252 1.0562 1.0562 1.0852 1.0852 1.1859 1.1859 1.2997 1.2997 1.3348 1.3348 1.4658 1.4658 1.6068 1.6068 1.6691 1.6691 1.8950 1.8950 2.1123 2.1123 2.8184 2.8184 5.3665 5.3665 5.8722 5.8722 5.9609 5.9609 9.1932 9.1932 9.3922 9.3922 9.4805 9.4805 9.7640 9.7640 k = 0.5000-0.0385 0.5852 ( 12588 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9390 -11.9390 -11.0256 -11.0256 -10.9677 -10.9677 -10.9580 -10.9580 -10.7565 -10.7565 -10.6945 -10.6945 -7.6735 -7.6735 -7.3873 -7.3873 -7.3725 -7.3725 -6.5164 -6.5164 -6.5149 -6.5149 -6.5104 -6.5104 -6.5040 -6.5040 -1.8223 -1.8223 -1.5849 -1.5849 -1.5049 -1.5049 0.2398 0.2398 0.3323 0.3323 0.5293 0.5293 0.8032 0.8032 1.0560 1.0560 1.0855 1.0855 1.1829 1.1829 1.3114 1.3114 1.3348 1.3348 1.4559 1.4559 1.6173 1.6173 1.6611 1.6611 1.9314 1.9314 2.0813 2.0813 2.8186 2.8186 5.3673 5.3673 5.8744 5.8744 5.9580 5.9580 9.2361 9.2361 9.4299 9.4299 9.4354 9.4354 9.7145 9.7145 k = 0.5000-0.0192 0.5988 ( 12580 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9389 -11.9389 -11.0270 -11.0270 -10.9677 -10.9677 -10.9580 -10.9580 -10.7510 -10.7510 -10.6986 -10.6986 -7.6736 -7.6736 -7.3872 -7.3872 -7.3725 -7.3725 -6.5160 -6.5160 -6.5150 -6.5150 -6.5102 -6.5102 -6.5044 -6.5044 -1.8227 -1.8227 -1.5842 -1.5842 -1.5064 -1.5064 0.2630 0.2630 0.3164 0.3164 0.5332 0.5332 0.7880 0.7880 1.0559 1.0559 1.0857 1.0857 1.1811 1.1811 1.3197 1.3197 1.3348 1.3348 1.4488 1.4488 1.6265 1.6265 1.6533 1.6533 1.9655 1.9655 2.0506 2.0506 2.8186 2.8186 5.3677 5.3677 5.8759 5.8759 5.9560 5.9560 9.2817 9.2817 9.3793 9.3793 9.4719 9.4719 9.6742 9.6742 k = 0.5000 0.0000 0.6124 ( 12568 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9389 -11.9389 -11.0275 -11.0275 -10.9677 -10.9677 -10.9580 -10.9580 -10.7490 -10.7490 -10.7002 -10.7002 -7.6737 -7.6737 -7.3872 -7.3872 -7.3726 -7.3726 -6.5159 -6.5159 -6.5150 -6.5150 -6.5102 -6.5102 -6.5046 -6.5046 -1.8228 -1.8228 -1.5839 -1.5839 -1.5069 -1.5069 0.2774 0.2774 0.3040 0.3040 0.5353 0.5353 0.7825 0.7825 1.0559 1.0559 1.0858 1.0858 1.1805 1.1805 1.3228 1.3228 1.3348 1.3348 1.4462 1.4462 1.6313 1.6313 1.6489 1.6489 1.9858 1.9858 2.0315 2.0315 2.8186 2.8186 5.3678 5.3678 5.8764 5.8764 5.9554 5.9554 9.3266 9.3266 9.3326 9.3326 9.4880 9.4880 9.6567 9.6567 k = 0.5000 0.0000 0.6124 ( 12568 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9389 -11.9389 -11.0275 -11.0275 -10.9677 -10.9677 -10.9580 -10.9580 -10.7490 -10.7490 -10.7002 -10.7002 -7.6737 -7.6737 -7.3872 -7.3872 -7.3726 -7.3726 -6.5159 -6.5159 -6.5150 -6.5150 -6.5102 -6.5102 -6.5046 -6.5046 -1.8228 -1.8228 -1.5839 -1.5839 -1.5069 -1.5069 0.2774 0.2774 0.3040 0.3040 0.5353 0.5353 0.7825 0.7825 1.0559 1.0559 1.0858 1.0858 1.1805 1.1805 1.3228 1.3228 1.3348 1.3348 1.4462 1.4462 1.6313 1.6313 1.6489 1.6489 1.9858 1.9858 2.0315 2.0315 2.8186 2.8186 5.3678 5.3678 5.8764 5.8764 5.9554 5.9554 9.3266 9.3266 9.3326 9.3326 9.4880 9.4880 9.6567 9.6567 k = 0.4886 0.0197 0.6124 ( 12586 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9390 -11.9390 -11.0278 -11.0278 -10.9674 -10.9674 -10.9576 -10.9576 -10.7499 -10.7499 -10.6995 -10.6995 -7.6737 -7.6737 -7.3872 -7.3872 -7.3726 -7.3726 -6.5160 -6.5160 -6.5150 -6.5150 -6.5102 -6.5102 -6.5045 -6.5045 -1.8233 -1.8233 -1.5844 -1.5844 -1.5059 -1.5059 0.2697 0.2697 0.3113 0.3113 0.5347 0.5347 0.7848 0.7848 1.0487 1.0487 1.0899 1.0899 1.1827 1.1827 1.3208 1.3208 1.3367 1.3367 1.4465 1.4465 1.6291 1.6291 1.6529 1.6529 1.9750 1.9750 2.0419 2.0419 2.8181 2.8181 5.3663 5.3663 5.8741 5.8741 5.9585 5.9585 9.2953 9.2953 9.3513 9.3513 9.4856 9.4856 9.6662 9.6662 k = 0.4773 0.0394 0.6124 ( 12576 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9392 -11.9392 -11.0286 -11.0286 -10.9665 -10.9665 -10.9565 -10.9565 -10.7524 -10.7524 -10.6977 -10.6977 -7.6740 -7.6740 -7.3873 -7.3873 -7.3726 -7.3726 -6.5162 -6.5162 -6.5151 -6.5151 -6.5103 -6.5103 -6.5044 -6.5044 -1.8250 -1.8250 -1.5853 -1.5853 -1.5031 -1.5031 0.2559 0.2559 0.3235 0.3235 0.5333 0.5333 0.7912 0.7912 1.0331 1.0331 1.0976 1.0976 1.1879 1.1879 1.3155 1.3155 1.3424 1.3424 1.4468 1.4468 1.6239 1.6239 1.6632 1.6632 1.9542 1.9542 2.0616 2.0616 2.8165 2.8165 5.3616 5.3616 5.8689 5.8689 5.9664 5.9664 9.2604 9.2604 9.3520 9.3520 9.4753 9.4753 9.6957 9.6957 k = 0.4659 0.0590 0.6124 ( 12581 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9395 -11.9395 -11.0299 -11.0299 -10.9655 -10.9655 -10.9545 -10.9545 -10.7561 -10.7561 -10.6951 -10.6951 -7.6743 -7.6743 -7.3874 -7.3874 -7.3727 -7.3727 -6.5165 -6.5165 -6.5152 -6.5152 -6.5104 -6.5104 -6.5041 -6.5041 -1.8275 -1.8275 -1.5865 -1.5865 -1.4991 -1.4991 0.2415 0.2415 0.3351 0.3351 0.5323 0.5323 0.8004 0.8004 1.0146 1.0146 1.1053 1.1053 1.1942 1.1942 1.3082 1.3082 1.3515 1.3515 1.4470 1.4470 1.6176 1.6176 1.6768 1.6768 1.9313 1.9313 2.0825 2.0825 2.8142 2.8142 5.3542 5.3542 5.8630 5.8630 5.9769 5.9769 9.2260 9.2260 9.3394 9.3394 9.4574 9.4574 9.7386 9.7386 k = 0.4545 0.0787 0.6124 ( 12585 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9398 -11.9398 -11.0315 -11.0315 -10.9647 -10.9647 -10.9516 -10.9516 -10.7604 -10.7604 -10.6922 -10.6922 -7.6746 -7.6746 -7.3875 -7.3875 -7.3728 -7.3728 -6.5169 -6.5169 -6.5153 -6.5153 -6.5105 -6.5105 -6.5038 -6.5038 -1.8308 -1.8308 -1.5874 -1.5874 -1.4945 -1.4945 0.2277 0.2277 0.3443 0.3443 0.5330 0.5330 0.8107 0.8107 0.9955 0.9955 1.1125 1.1125 1.2004 1.2004 1.2996 1.2996 1.3631 1.3631 1.4473 1.4473 1.6111 1.6111 1.6917 1.6917 1.9081 1.9081 2.1027 2.1027 2.8114 2.8114 5.3446 5.3446 5.8576 5.8576 5.9882 5.9882 9.1933 9.1933 9.3200 9.3200 9.4352 9.4352 9.7841 9.7841 k = 0.4432 0.0984 0.6124 ( 12580 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9402 -11.9402 -11.0332 -11.0332 -10.9641 -10.9641 -10.9480 -10.9480 -10.7651 -10.7651 -10.6892 -10.6892 -7.6750 -7.6750 -7.3877 -7.3877 -7.3729 -7.3729 -6.5173 -6.5173 -6.5155 -6.5155 -6.5106 -6.5106 -6.5035 -6.5035 -1.8345 -1.8345 -1.5881 -1.5881 -1.4895 -1.4895 0.2153 0.2153 0.3505 0.3505 0.5362 0.5362 0.8206 0.8206 0.9774 0.9774 1.1194 1.1194 1.2060 1.2060 1.2903 1.2903 1.3759 1.3759 1.4485 1.4485 1.6047 1.6047 1.7068 1.7068 1.8856 1.8856 2.1215 2.1215 2.8083 2.8083 5.3337 5.3337 5.8534 5.8534 5.9994 5.9994 9.1632 9.1632 9.2981 9.2981 9.4121 9.4121 9.8217 9.8217 k = 0.4318 0.1181 0.6124 ( 12580 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9405 -11.9405 -11.0349 -11.0349 -10.9637 -10.9637 -10.9441 -10.9441 -10.7697 -10.7697 -10.6865 -10.6865 -7.6754 -7.6754 -7.3878 -7.3878 -7.3730 -7.3730 -6.5177 -6.5177 -6.5157 -6.5157 -6.5107 -6.5107 -6.5032 -6.5032 -1.8382 -1.8382 -1.5885 -1.5885 -1.4847 -1.4847 0.2043 0.2043 0.3537 0.3537 0.5421 0.5421 0.8282 0.8282 0.9616 0.9616 1.1259 1.1259 1.2109 1.2109 1.2808 1.2808 1.3879 1.3879 1.4517 1.4517 1.5984 1.5984 1.7207 1.7207 1.8644 1.8644 2.1382 2.1382 2.8053 2.8053 5.3224 5.3224 5.8502 5.8502 6.0099 6.0099 9.1366 9.1366 9.2763 9.2763 9.3901 9.3901 9.8449 9.8449 k = 0.4205 0.1378 0.6124 ( 12578 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9409 -11.9409 -11.0364 -11.0364 -10.9634 -10.9634 -10.9403 -10.9403 -10.7740 -10.7740 -10.6841 -10.6841 -7.6758 -7.6758 -7.3880 -7.3880 -7.3731 -7.3731 -6.5180 -6.5180 -6.5158 -6.5158 -6.5108 -6.5108 -6.5030 -6.5030 -1.8418 -1.8418 -1.5887 -1.5887 -1.4803 -1.4803 0.1950 0.1950 0.3547 0.3547 0.5501 0.5501 0.8326 0.8326 0.9495 0.9495 1.1319 1.1319 1.2154 1.2154 1.2713 1.2713 1.3973 1.3973 1.4579 1.4579 1.5925 1.5925 1.7326 1.7326 1.8455 1.8455 2.1525 2.1525 2.8024 2.8024 5.3117 5.3117 5.8481 5.8481 6.0192 6.0192 9.1141 9.1141 9.2564 9.2564 9.3707 9.3707 9.8558 9.8558 k = 0.4091 0.1575 0.6124 ( 12592 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9411 -11.9411 -11.0377 -11.0377 -10.9632 -10.9632 -10.9368 -10.9368 -10.7777 -10.7777 -10.6822 -10.6822 -7.6761 -7.6761 -7.3881 -7.3881 -7.3732 -7.3732 -6.5183 -6.5183 -6.5160 -6.5160 -6.5109 -6.5109 -6.5028 -6.5028 -1.8449 -1.8449 -1.5887 -1.5887 -1.4766 -1.4766 0.1876 0.1876 0.3542 0.3542 0.5587 0.5587 0.8332 0.8332 0.9416 0.9416 1.1371 1.1371 1.2197 1.2197 1.2623 1.2623 1.4031 1.4031 1.4667 1.4667 1.5871 1.5871 1.7418 1.7418 1.8299 1.8299 2.1639 2.1639 2.8000 2.8000 5.3023 5.3023 5.8467 5.8467 6.0267 6.0267 9.0961 9.0961 9.2398 9.2398 9.3548 9.3548 9.8601 9.8601 k = 0.3977 0.1771 0.6124 ( 12602 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9414 -11.9414 -11.0386 -11.0386 -10.9631 -10.9631 -10.9341 -10.9341 -10.7805 -10.7805 -10.6808 -10.6808 -7.6763 -7.6763 -7.3882 -7.3882 -7.3732 -7.3732 -6.5185 -6.5185 -6.5161 -6.5161 -6.5109 -6.5109 -6.5026 -6.5026 -1.8472 -1.8472 -1.5886 -1.5886 -1.4739 -1.4739 0.1822 0.1822 0.3532 0.3532 0.5666 0.5666 0.8312 0.8312 0.9376 0.9376 1.1413 1.1413 1.2241 1.2241 1.2539 1.2539 1.4061 1.4061 1.4761 1.4761 1.5825 1.5825 1.7477 1.7477 1.8186 1.8186 2.1723 2.1723 2.7981 2.7981 5.2951 5.2951 5.8458 5.8458 6.0324 6.0324 9.0830 9.0830 9.2273 9.2273 9.3431 9.3431 9.8615 9.8615 k = 0.3864 0.1968 0.6124 ( 12609 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9415 -11.9415 -11.0392 -11.0392 -10.9630 -10.9630 -10.9324 -10.9324 -10.7823 -10.7823 -10.6799 -10.6799 -7.6764 -7.6764 -7.3883 -7.3883 -7.3733 -7.3733 -6.5187 -6.5187 -6.5161 -6.5161 -6.5109 -6.5109 -6.5025 -6.5025 -1.8487 -1.8487 -1.5886 -1.5886 -1.4721 -1.4721 0.1790 0.1790 0.3523 0.3523 0.5720 0.5720 0.8287 0.8287 0.9359 0.9359 1.1440 1.1440 1.2285 1.2285 1.2469 1.2469 1.4074 1.4074 1.4832 1.4832 1.5793 1.5793 1.7505 1.7505 1.8120 1.8120 2.1775 2.1775 2.7969 2.7969 5.2905 5.2905 5.8454 5.8454 6.0359 6.0359 9.0750 9.0750 9.2195 9.2195 9.3358 9.3358 9.8619 9.8619 k = 0.3750 0.2165 0.6124 ( 12600 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9415 -11.9415 -11.0394 -11.0394 -10.9630 -10.9630 -10.9318 -10.9318 -10.7830 -10.7830 -10.6796 -10.6796 -7.6765 -7.6765 -7.3883 -7.3883 -7.3733 -7.3733 -6.5187 -6.5187 -6.5162 -6.5162 -6.5109 -6.5109 -6.5025 -6.5025 -1.8492 -1.8492 -1.5885 -1.5885 -1.4715 -1.4715 0.1779 0.1779 0.3519 0.3519 0.5740 0.5740 0.8276 0.8276 0.9355 0.9355 1.1449 1.1449 1.2310 1.2310 1.2435 1.2435 1.4078 1.4078 1.4858 1.4858 1.5781 1.5781 1.7513 1.7513 1.8100 1.8100 2.1792 2.1792 2.7965 2.7965 5.2890 5.2890 5.8452 5.8452 6.0370 6.0370 9.0723 9.0723 9.2169 9.2169 9.3334 9.3334 9.8619 9.8619 k = 0.3750 0.2165 0.6124 ( 12600 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9415 -11.9415 -11.0394 -11.0394 -10.9630 -10.9630 -10.9318 -10.9318 -10.7830 -10.7830 -10.6796 -10.6796 -7.6765 -7.6765 -7.3883 -7.3883 -7.3733 -7.3733 -6.5187 -6.5187 -6.5162 -6.5162 -6.5109 -6.5109 -6.5025 -6.5025 -1.8492 -1.8492 -1.5885 -1.5885 -1.4715 -1.4715 0.1779 0.1779 0.3519 0.3519 0.5740 0.5740 0.8276 0.8276 0.9355 0.9355 1.1449 1.1449 1.2310 1.2310 1.2435 1.2435 1.4078 1.4078 1.4858 1.4858 1.5781 1.5781 1.7513 1.7513 1.8100 1.8100 2.1792 2.1792 2.7965 2.7965 5.2890 5.2890 5.8452 5.8452 6.0370 6.0370 9.0723 9.0723 9.2169 9.2169 9.3334 9.3334 9.8619 9.8619 k = 0.3629 0.2095 0.5926 ( 12602 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9422 -11.9422 -11.0461 -11.0461 -10.9628 -10.9628 -10.9263 -10.9263 -10.7737 -10.7737 -10.6856 -10.6856 -7.6782 -7.6782 -7.3882 -7.3882 -7.3739 -7.3739 -6.5185 -6.5185 -6.5168 -6.5168 -6.5107 -6.5107 -6.5034 -6.5034 -1.8581 -1.8581 -1.5907 -1.5907 -1.4653 -1.4653 0.1995 0.1995 0.3693 0.3693 0.5618 0.5618 0.8035 0.8035 0.9087 0.9087 1.1476 1.1476 1.2359 1.2359 1.2518 1.2518 1.3959 1.3959 1.5024 1.5024 1.5886 1.5886 1.7736 1.7736 1.8335 1.8335 2.1591 2.1591 2.7878 2.7878 5.2687 5.2687 5.8366 5.8366 6.0547 6.0547 9.0844 9.0844 9.1568 9.1568 9.3204 9.3204 9.8292 9.8292 k = 0.3508 0.2025 0.5729 ( 12586 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9432 -11.9432 -11.0520 -11.0520 -10.9627 -10.9627 -10.9206 -10.9206 -10.7647 -10.7647 -10.6918 -10.6918 -7.6802 -7.6802 -7.3883 -7.3883 -7.3745 -7.3745 -6.5184 -6.5184 -6.5174 -6.5174 -6.5105 -6.5105 -6.5043 -6.5043 -1.8674 -1.8674 -1.5942 -1.5942 -1.4576 -1.4576 0.2220 0.2220 0.3793 0.3793 0.5574 0.5574 0.7818 0.7818 0.8825 0.8825 1.1498 1.1498 1.2382 1.2382 1.2596 1.2596 1.3841 1.3841 1.5243 1.5243 1.5985 1.5985 1.7946 1.7946 1.8601 1.8601 2.1390 2.1390 2.7770 2.7770 5.2470 5.2470 5.8259 5.8259 6.0732 6.0732 9.0694 9.0694 9.0927 9.0927 9.3286 9.3286 9.7876 9.7876 k = 0.3387 0.1956 0.5531 ( 12590 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9445 -11.9445 -11.0570 -11.0570 -10.9625 -10.9625 -10.9148 -10.9148 -10.7561 -10.7561 -10.6981 -10.6981 -7.6826 -7.6826 -7.3884 -7.3884 -7.3752 -7.3752 -6.5190 -6.5190 -6.5177 -6.5177 -6.5104 -6.5104 -6.5051 -6.5051 -1.8767 -1.8767 -1.5989 -1.5989 -1.4491 -1.4491 0.2450 0.2450 0.3805 0.3805 0.5614 0.5614 0.7639 0.7639 0.8579 0.8579 1.1522 1.1522 1.2345 1.2345 1.2679 1.2679 1.3776 1.3776 1.5486 1.5486 1.6080 1.6080 1.8152 1.8152 1.8883 1.8883 2.1194 2.1194 2.7637 2.7637 5.2244 5.2244 5.8135 5.8135 6.0913 6.0913 8.9739 8.9739 9.0966 9.0966 9.3389 9.3389 9.7409 9.7409 k = 0.3266 0.1886 0.5334 ( 12596 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9462 -11.9462 -11.0609 -11.0609 -10.9623 -10.9623 -10.9090 -10.9090 -10.7478 -10.7478 -10.7042 -10.7042 -7.6854 -7.6854 -7.3887 -7.3887 -7.3760 -7.3760 -6.5200 -6.5200 -6.5178 -6.5178 -6.5105 -6.5105 -6.5058 -6.5058 -1.8858 -1.8858 -1.6044 -1.6044 -1.4406 -1.4406 0.2679 0.2679 0.3742 0.3742 0.5710 0.5710 0.7513 0.7513 0.8354 0.8354 1.1546 1.1546 1.2238 1.2238 1.2776 1.2776 1.3782 1.3782 1.5742 1.5742 1.6171 1.6171 1.8360 1.8360 1.9173 1.9173 2.1004 2.1004 2.7478 2.7478 5.2016 5.2016 5.7995 5.7995 6.1079 6.1079 8.8749 8.8749 9.0953 9.0953 9.3460 9.3460 9.6924 9.6924 k = 0.3145 0.1816 0.5136 ( 12600 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9483 -11.9483 -11.0638 -11.0638 -10.9620 -10.9620 -10.9034 -10.9034 -10.7399 -10.7399 -10.7101 -10.7101 -7.6886 -7.6886 -7.3892 -7.3892 -7.3768 -7.3768 -6.5213 -6.5213 -6.5179 -6.5179 -6.5109 -6.5109 -6.5063 -6.5063 -1.8944 -1.8944 -1.6107 -1.6107 -1.4328 -1.4328 0.2900 0.2900 0.3632 0.3632 0.5818 0.5818 0.7455 0.7455 0.8159 0.8159 1.1562 1.1562 1.2096 1.2096 1.2885 1.2885 1.3846 1.3846 1.6002 1.6002 1.6258 1.6258 1.8572 1.8572 1.9462 1.9462 2.0826 2.0826 2.7292 2.7292 5.1794 5.1794 5.7843 5.7843 6.1220 6.1220 8.7741 8.7741 9.0885 9.0885 9.3470 9.3470 9.6457 9.6457 k = 0.3024 0.1746 0.4938 ( 12592 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9507 -11.9507 -11.0656 -11.0656 -10.9618 -10.9618 -10.8981 -10.8981 -10.7324 -10.7324 -10.7156 -10.7156 -7.6923 -7.6923 -7.3898 -7.3898 -7.3777 -7.3777 -6.5227 -6.5227 -6.5181 -6.5181 -6.5117 -6.5117 -6.5066 -6.5066 -1.9023 -1.9023 -1.6174 -1.6174 -1.4264 -1.4264 0.3106 0.3106 0.3501 0.3501 0.5906 0.5906 0.7466 0.7466 0.8008 0.8008 1.1545 1.1545 1.1978 1.1978 1.3003 1.3003 1.3948 1.3948 1.6259 1.6259 1.6346 1.6346 1.8788 1.8788 1.9743 1.9743 2.0667 2.0667 2.7079 2.7079 5.1582 5.1582 5.7679 5.7679 6.1327 6.1327 8.6724 8.6724 9.0757 9.0757 9.3392 9.3392 9.6044 9.6044 k = 0.2903 0.1676 0.4741 ( 12600 PWs) bands (ev): -22.7091 -22.7091 -22.7088 -22.7088 -11.9536 -11.9536 -11.0663 -11.0663 -10.9614 -10.9614 -10.8934 -10.8934 -10.7253 -10.7253 -10.7204 -10.7204 -7.6965 -7.6965 -7.3906 -7.3906 -7.3786 -7.3786 -6.5243 -6.5243 -6.5182 -6.5182 -6.5129 -6.5129 -6.5068 -6.5068 -1.9093 -1.9093 -1.6243 -1.6243 -1.4219 -1.4219 0.3277 0.3277 0.3374 0.3374 0.5964 0.5964 0.7520 0.7520 0.7926 0.7926 1.1466 1.1466 1.1943 1.1943 1.3128 1.3128 1.4073 1.4073 1.6403 1.6403 1.6542 1.6542 1.9005 1.9005 2.0002 2.0002 2.0545 2.0545 2.6838 2.6838 5.1384 5.1384 5.7506 5.7506 6.1392 6.1392 8.5702 8.5702 9.0568 9.0568 9.3203 9.3203 9.5716 9.5716 k = 0.2782 0.1606 0.4543 ( 12582 PWs) bands (ev): -22.7091 -22.7091 -22.7087 -22.7087 -11.9568 -11.9568 -11.0659 -11.0659 -10.9611 -10.9611 -10.8893 -10.8893 -10.7245 -10.7245 -10.7185 -10.7185 -7.7012 -7.7012 -7.3916 -7.3916 -7.3795 -7.3795 -6.5260 -6.5260 -6.5185 -6.5185 -6.5142 -6.5142 -6.5069 -6.5069 -1.9153 -1.9153 -1.6315 -1.6315 -1.4197 -1.4197 0.3211 0.3211 0.3455 0.3455 0.5999 0.5999 0.7566 0.7566 0.7949 0.7949 1.1356 1.1356 1.1983 1.1983 1.3257 1.3257 1.4210 1.4210 1.6476 1.6476 1.6802 1.6802 1.9213 1.9213 2.0177 2.0177 2.0529 2.0529 2.6570 2.6570 5.1205 5.1205 5.7323 5.7323 6.1410 6.1410 8.4680 8.4680 9.0319 9.0319 9.2898 9.2898 9.5484 9.5484 k = 0.2661 0.1536 0.4346 ( 12584 PWs) bands (ev): -22.7092 -22.7092 -22.7087 -22.7087 -11.9604 -11.9604 -11.0645 -11.0645 -10.9606 -10.9606 -10.8862 -10.8862 -10.7274 -10.7274 -10.7121 -10.7121 -7.7064 -7.7064 -7.3928 -7.3928 -7.3805 -7.3805 -6.5277 -6.5277 -6.5188 -6.5188 -6.5158 -6.5158 -6.5071 -6.5071 -1.9202 -1.9202 -1.6386 -1.6386 -1.4202 -1.4202 0.3081 0.3081 0.3568 0.3568 0.6021 0.6021 0.7600 0.7600 0.8064 0.8064 1.1268 1.1268 1.2064 1.2064 1.3390 1.3390 1.4354 1.4354 1.6539 1.6539 1.7062 1.7062 1.9391 1.9391 2.0210 2.0210 2.0699 2.0699 2.6276 2.6276 5.1046 5.1046 5.7134 5.7134 6.1377 6.1377 8.3662 8.3662 9.0011 9.0011 9.2498 9.2498 9.4730 9.4730 k = 0.2540 0.1467 0.4148 ( 12588 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9644 -11.9644 -11.0620 -11.0620 -10.9602 -10.9602 -10.8842 -10.8842 -10.7291 -10.7291 -10.7062 -10.7062 -7.7121 -7.7121 -7.3942 -7.3942 -7.3814 -7.3814 -6.5295 -6.5295 -6.5192 -6.5192 -6.5175 -6.5175 -6.5074 -6.5074 -1.9240 -1.9240 -1.6457 -1.6457 -1.4236 -1.4236 0.2959 0.2959 0.3642 0.3642 0.6030 0.6030 0.7665 0.7665 0.8218 0.8218 1.1231 1.1231 1.2169 1.2169 1.3524 1.3524 1.4500 1.4500 1.6596 1.6596 1.7318 1.7318 1.9500 1.9500 2.0254 2.0254 2.0938 2.0938 2.5959 2.5959 5.0908 5.0908 5.6940 5.6940 6.1290 6.1290 8.2650 8.2650 8.9648 8.9648 9.2034 9.2034 9.3890 9.3890 k = 0.2419 0.1397 0.3951 ( 12580 PWs) bands (ev): -22.7093 -22.7093 -22.7086 -22.7086 -11.9686 -11.9686 -11.0586 -11.0586 -10.9596 -10.9596 -10.8835 -10.8835 -10.7295 -10.7295 -10.7005 -10.7005 -7.7183 -7.7183 -7.3956 -7.3956 -7.3824 -7.3824 -6.5314 -6.5314 -6.5200 -6.5200 -6.5189 -6.5189 -6.5079 -6.5079 -1.9265 -1.9265 -1.6526 -1.6526 -1.4300 -1.4300 0.2848 0.2848 0.3676 0.3676 0.6020 0.6020 0.7783 0.7783 0.8386 0.8386 1.1259 1.1259 1.2291 1.2291 1.3659 1.3659 1.4646 1.4646 1.6645 1.6645 1.7571 1.7571 1.9520 1.9520 2.0390 2.0390 2.1187 2.1187 2.5621 2.5621 5.0792 5.0792 5.6742 5.6742 6.1148 6.1148 8.1647 8.1647 8.9235 8.9235 9.1534 9.1534 9.3070 9.3070 k = 0.2298 0.1327 0.3753 ( 12590 PWs) bands (ev): -22.7093 -22.7093 -22.7085 -22.7085 -11.9732 -11.9732 -11.0543 -11.0543 -10.9591 -10.9591 -10.8840 -10.8840 -10.7285 -10.7285 -10.6953 -10.6953 -7.7250 -7.7250 -7.3973 -7.3973 -7.3834 -7.3834 -6.5333 -6.5333 -6.5218 -6.5218 -6.5195 -6.5195 -6.5084 -6.5084 -1.9279 -1.9279 -1.6592 -1.6592 -1.4391 -1.4391 0.2748 0.2748 0.3672 0.3672 0.5987 0.5987 0.7958 0.7958 0.8568 0.8568 1.1351 1.1351 1.2428 1.2428 1.3793 1.3793 1.4790 1.4790 1.6687 1.6687 1.7819 1.7819 1.9481 1.9481 2.0596 2.0596 2.1431 2.1431 2.5266 2.5266 5.0696 5.0696 5.6543 5.6543 6.0951 6.0951 8.0658 8.0658 8.8779 8.8779 9.1018 9.1018 9.2273 9.2273 k = 0.2177 0.1257 0.3556 ( 12590 PWs) bands (ev): -22.7094 -22.7094 -22.7085 -22.7085 -11.9780 -11.9780 -11.0492 -11.0492 -10.9585 -10.9585 -10.8857 -10.8857 -10.7262 -10.7262 -10.6903 -10.6903 -7.7321 -7.7321 -7.3990 -7.3990 -7.3844 -7.3844 -6.5352 -6.5352 -6.5239 -6.5239 -6.5199 -6.5199 -6.5091 -6.5091 -1.9282 -1.9282 -1.6655 -1.6655 -1.4509 -1.4509 0.2661 0.2661 0.3637 0.3637 0.5924 0.5924 0.8183 0.8183 0.8774 0.8774 1.1499 1.1499 1.2577 1.2577 1.3924 1.3924 1.4929 1.4929 1.6723 1.6723 1.8061 1.8061 1.9421 1.9421 2.0839 2.0839 2.1668 2.1668 2.4900 2.4900 5.0620 5.0620 5.6344 5.6344 6.0702 6.0702 7.9684 7.9684 8.8286 8.8286 9.0498 9.0498 9.1502 9.1502 k = 0.2056 0.1187 0.3358 ( 12596 PWs) bands (ev): -22.7094 -22.7094 -22.7084 -22.7084 -11.9830 -11.9830 -11.0434 -11.0434 -10.9579 -10.9579 -10.8885 -10.8885 -10.7228 -10.7228 -10.6857 -10.6857 -7.7397 -7.7397 -7.4007 -7.4007 -7.3855 -7.3855 -6.5371 -6.5371 -6.5262 -6.5262 -6.5203 -6.5203 -6.5099 -6.5099 -1.9275 -1.9275 -1.6713 -1.6713 -1.4650 -1.4650 0.2586 0.2586 0.3576 0.3576 0.5832 0.5832 0.8452 0.8452 0.9013 0.9013 1.1689 1.1689 1.2737 1.2737 1.4052 1.4052 1.5061 1.5061 1.6754 1.6754 1.8296 1.8296 1.9358 1.9358 2.1100 2.1100 2.1895 2.1895 2.4527 2.4527 5.0559 5.0559 5.6148 5.6148 6.0402 6.0402 7.8730 7.8730 8.7766 8.7766 8.9980 8.9980 9.0760 9.0760 k = 0.1935 0.1117 0.3161 ( 12598 PWs) bands (ev): -22.7095 -22.7095 -22.7084 -22.7084 -11.9881 -11.9881 -11.0370 -11.0370 -10.9572 -10.9572 -10.8921 -10.8921 -10.7184 -10.7184 -10.6815 -10.6815 -7.7476 -7.7476 -7.4026 -7.4026 -7.3865 -7.3865 -6.5390 -6.5390 -6.5286 -6.5286 -6.5207 -6.5207 -6.5108 -6.5108 -1.9260 -1.9260 -1.6766 -1.6766 -1.4810 -1.4810 0.2522 0.2522 0.3495 0.3495 0.5715 0.5715 0.8760 0.8760 0.9287 0.9287 1.1907 1.1907 1.2906 1.2906 1.4174 1.4174 1.5186 1.5186 1.6782 1.6782 1.8522 1.8522 1.9298 1.9298 2.1368 2.1368 2.2110 2.2110 2.4156 2.4156 5.0511 5.0511 5.5957 5.5957 6.0058 6.0058 7.7798 7.7798 8.7226 8.7226 8.9469 8.9469 9.0048 9.0048 k = 0.1815 0.1048 0.2963 ( 12596 PWs) bands (ev): -22.7095 -22.7095 -22.7084 -22.7084 -11.9933 -11.9933 -11.0301 -11.0301 -10.9565 -10.9565 -10.8963 -10.8963 -10.7133 -10.7133 -10.6775 -10.6775 -7.7557 -7.7557 -7.4044 -7.4044 -7.3875 -7.3875 -6.5408 -6.5408 -6.5310 -6.5310 -6.5211 -6.5211 -6.5118 -6.5118 -1.9239 -1.9239 -1.6813 -1.6813 -1.4984 -1.4984 0.2468 0.2468 0.3400 0.3400 0.5577 0.5577 0.9104 0.9104 0.9592 0.9592 1.2140 1.2140 1.3081 1.3081 1.4289 1.4289 1.5300 1.5300 1.6807 1.6807 1.8737 1.8737 1.9246 1.9246 2.1639 2.1639 2.2307 2.2307 2.3797 2.3797 5.0472 5.0472 5.5774 5.5774 5.9674 5.9674 7.6892 7.6892 8.6674 8.6674 8.8967 8.8967 8.9369 8.9369 k = 0.1694 0.0978 0.2766 ( 12594 PWs) bands (ev): -22.7096 -22.7096 -22.7083 -22.7083 -11.9984 -11.9984 -11.0229 -11.0229 -10.9558 -10.9558 -10.9010 -10.9010 -10.7076 -10.7076 -10.6739 -10.6739 -7.7641 -7.7641 -7.4062 -7.4062 -7.3886 -7.3886 -6.5426 -6.5426 -6.5335 -6.5335 -6.5215 -6.5215 -6.5129 -6.5129 -1.9214 -1.9214 -1.6854 -1.6854 -1.5168 -1.5168 0.2424 0.2424 0.3296 0.3296 0.5427 0.5427 0.9478 0.9478 0.9921 0.9921 1.2379 1.2379 1.3262 1.3262 1.4395 1.4395 1.5402 1.5402 1.6833 1.6833 1.8934 1.8934 1.9205 1.9205 2.1909 2.1909 2.2474 2.2474 2.3472 2.3472 5.0438 5.0438 5.5602 5.5602 5.9257 5.9257 7.6016 7.6016 8.6118 8.6118 8.8476 8.8476 8.8726 8.8726 k = 0.1573 0.0908 0.2568 ( 12578 PWs) bands (ev): -22.7096 -22.7096 -22.7083 -22.7083 -12.0035 -12.0035 -11.0154 -11.0154 -10.9551 -10.9551 -10.9060 -10.9060 -10.7017 -10.7017 -10.6705 -10.6705 -7.7725 -7.7725 -7.4080 -7.4080 -7.3896 -7.3896 -6.5443 -6.5443 -6.5360 -6.5360 -6.5219 -6.5219 -6.5140 -6.5140 -1.9186 -1.9186 -1.6887 -1.6887 -1.5358 -1.5358 0.2388 0.2388 0.3186 0.3186 0.5273 0.5273 0.9876 0.9876 1.0268 1.0268 1.2616 1.2616 1.3446 1.3446 1.4491 1.4491 1.5489 1.5489 1.6861 1.6861 1.9090 1.9090 1.9191 1.9191 2.2175 2.2175 2.2565 2.2565 2.3236 2.3236 5.0403 5.0403 5.5443 5.5443 5.8816 5.8816 7.5174 7.5174 8.5566 8.5566 8.7997 8.7997 8.8120 8.8120 k = 0.1452 0.0838 0.2370 ( 12592 PWs) bands (ev): -22.7097 -22.7097 -22.7082 -22.7082 -12.0085 -12.0085 -11.0079 -11.0079 -10.9544 -10.9544 -10.9111 -10.9111 -10.6956 -10.6956 -10.6674 -10.6674 -7.7809 -7.7809 -7.4097 -7.4097 -7.3906 -7.3906 -6.5460 -6.5460 -6.5385 -6.5385 -6.5223 -6.5223 -6.5152 -6.5152 -1.9159 -1.9159 -1.6911 -1.6911 -1.5547 -1.5547 0.2358 0.2358 0.3073 0.3073 0.5119 0.5119 1.0287 1.0287 1.0630 1.0630 1.2843 1.2843 1.3632 1.3632 1.4576 1.4576 1.5558 1.5558 1.6893 1.6893 1.9112 1.9112 1.9294 1.9294 2.2435 2.2435 2.2494 2.2494 2.3184 2.3184 5.0363 5.0363 5.5300 5.5300 5.8359 5.8359 7.4369 7.4369 8.5025 8.5025 8.7520 8.7520 8.7565 8.7565 k = 0.1331 0.0768 0.2173 ( 12592 PWs) bands (ev): -22.7097 -22.7097 -22.7082 -22.7082 -12.0133 -12.0133 -11.0004 -11.0004 -10.9537 -10.9537 -10.9161 -10.9161 -10.6895 -10.6895 -10.6647 -10.6647 -7.7892 -7.7892 -7.4114 -7.4114 -7.3916 -7.3916 -6.5475 -6.5475 -6.5410 -6.5410 -6.5226 -6.5226 -6.5164 -6.5164 -1.9134 -1.9134 -1.6928 -1.6928 -1.5733 -1.5733 0.2335 0.2335 0.2961 0.2961 0.4971 0.4971 1.0699 1.0699 1.1004 1.1004 1.3057 1.3057 1.3816 1.3816 1.4649 1.4649 1.5605 1.5605 1.6931 1.6931 1.9093 1.9093 1.9412 1.9412 2.2307 2.2307 2.2690 2.2690 2.3278 2.3278 5.0315 5.0315 5.5174 5.5174 5.7895 5.7895 7.3605 7.3605 8.4502 8.4502 8.7012 8.7012 8.7095 8.7095 k = 0.1210 0.0698 0.1975 ( 12576 PWs) bands (ev): -22.7097 -22.7097 -22.7082 -22.7082 -12.0179 -12.0179 -10.9932 -10.9932 -10.9530 -10.9530 -10.9209 -10.9209 -10.6835 -10.6835 -10.6621 -10.6621 -7.7973 -7.7973 -7.4130 -7.4130 -7.3926 -7.3926 -6.5490 -6.5490 -6.5433 -6.5433 -6.5230 -6.5230 -6.5177 -6.5177 -1.9113 -1.9113 -1.6935 -1.6935 -1.5911 -1.5911 0.2315 0.2315 0.2852 0.2852 0.4834 0.4834 1.1099 1.1099 1.1392 1.1392 1.3254 1.3254 1.3996 1.3996 1.4709 1.4709 1.5629 1.5629 1.6977 1.6977 1.9074 1.9074 1.9493 1.9493 2.2122 2.2122 2.2933 2.2933 2.3418 2.3418 5.0256 5.0256 5.5067 5.5067 5.7435 5.7435 7.2888 7.2888 8.4003 8.4003 8.6526 8.6526 8.6661 8.6661 k = 0.1089 0.0629 0.1778 ( 12560 PWs) bands (ev): -22.7098 -22.7098 -22.7081 -22.7081 -12.0223 -12.0223 -10.9863 -10.9863 -10.9523 -10.9523 -10.9254 -10.9254 -10.6779 -10.6779 -10.6599 -10.6599 -7.8050 -7.8050 -7.4145 -7.4145 -7.3935 -7.3935 -6.5503 -6.5503 -6.5455 -6.5455 -6.5233 -6.5233 -6.5188 -6.5188 -1.9099 -1.9099 -1.6935 -1.6935 -1.6077 -1.6077 0.2299 0.2299 0.2747 0.2747 0.4709 0.4709 1.1478 1.1478 1.1793 1.1793 1.3433 1.3433 1.4168 1.4168 1.4756 1.4756 1.5625 1.5625 1.7030 1.7030 1.9060 1.9060 1.9528 1.9528 2.1980 2.1980 2.3166 2.3166 2.3565 2.3565 5.0183 5.0183 5.4981 5.4981 5.6987 5.6987 7.2221 7.2221 8.3533 8.3533 8.6081 8.6081 8.6247 8.6247 k = 0.0968 0.0559 0.1580 ( 12551 PWs) bands (ev): -22.7098 -22.7098 -22.7081 -22.7081 -12.0262 -12.0262 -10.9798 -10.9798 -10.9516 -10.9516 -10.9296 -10.9296 -10.6725 -10.6725 -10.6579 -10.6579 -7.8123 -7.8123 -7.4158 -7.4158 -7.3944 -7.3944 -6.5516 -6.5516 -6.5476 -6.5476 -6.5236 -6.5236 -6.5200 -6.5200 -1.9091 -1.9091 -1.6927 -1.6927 -1.6230 -1.6230 0.2285 0.2285 0.2647 0.2647 0.4599 0.4599 1.1835 1.1835 1.2195 1.2195 1.3592 1.3592 1.4328 1.4328 1.4791 1.4791 1.5592 1.5592 1.7088 1.7088 1.9049 1.9049 1.9517 1.9517 2.1893 2.1893 2.3384 2.3384 2.3709 2.3709 5.0096 5.0096 5.4913 5.4913 5.6562 5.6562 7.1609 7.1609 8.3098 8.3098 8.5679 8.5679 8.5855 8.5855 k = 0.0847 0.0489 0.1383 ( 12559 PWs) bands (ev): -22.7098 -22.7098 -22.7081 -22.7081 -12.0299 -12.0299 -10.9741 -10.9741 -10.9509 -10.9509 -10.9333 -10.9333 -10.6677 -10.6677 -10.6562 -10.6562 -7.8190 -7.8190 -7.4171 -7.4171 -7.3952 -7.3952 -6.5527 -6.5527 -6.5496 -6.5496 -6.5239 -6.5239 -6.5210 -6.5210 -1.9089 -1.9089 -1.6913 -1.6913 -1.6366 -1.6366 0.2272 0.2272 0.2555 0.2555 0.4503 0.4503 1.2173 1.2173 1.2586 1.2586 1.3732 1.3732 1.4472 1.4472 1.4815 1.4815 1.5530 1.5530 1.7150 1.7150 1.9043 1.9043 1.9468 1.9468 2.1857 2.1857 2.3587 2.3587 2.3844 2.3844 4.9998 4.9998 5.4863 5.4863 5.6169 5.6169 7.1055 7.1055 8.2703 8.2703 8.5322 8.5322 8.5491 8.5491 k = 0.0726 0.0419 0.1185 ( 12569 PWs) bands (ev): -22.7099 -22.7099 -22.7081 -22.7081 -12.0331 -12.0331 -10.9692 -10.9692 -10.9500 -10.9500 -10.9365 -10.9365 -10.6633 -10.6633 -10.6547 -10.6547 -7.8250 -7.8250 -7.4182 -7.4182 -7.3959 -7.3959 -6.5536 -6.5536 -6.5513 -6.5513 -6.5242 -6.5242 -6.5220 -6.5220 -1.9093 -1.9093 -1.6895 -1.6895 -1.6485 -1.6485 0.2261 0.2261 0.2473 0.2473 0.4422 0.4422 1.2494 1.2494 1.2955 1.2955 1.3852 1.3852 1.4595 1.4595 1.4826 1.4826 1.5441 1.5441 1.7213 1.7213 1.9041 1.9041 1.9395 1.9395 2.1859 2.1859 2.3773 2.3773 2.3968 2.3968 4.9891 4.9891 5.4829 5.4829 5.5815 5.5815 7.0566 7.0566 8.2351 8.2351 8.5010 8.5010 8.5158 8.5158 k = 0.0605 0.0349 0.0988 ( 12545 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0358 -12.0358 -10.9654 -10.9654 -10.9490 -10.9490 -10.9391 -10.9391 -10.6595 -10.6595 -10.6534 -10.6534 -7.8303 -7.8303 -7.4191 -7.4191 -7.3965 -7.3965 -6.5545 -6.5545 -6.5528 -6.5528 -6.5244 -6.5244 -6.5228 -6.5228 -1.9101 -1.9101 -1.6875 -1.6875 -1.6585 -1.6585 0.2252 0.2252 0.2400 0.2400 0.4356 0.4356 1.2801 1.2801 1.3293 1.3293 1.3953 1.3953 1.4693 1.4693 1.4829 1.4829 1.5329 1.5329 1.7272 1.7272 1.9042 1.9042 1.9312 1.9312 2.1885 2.1885 2.3938 2.3938 2.4078 2.4078 4.9783 4.9783 5.4807 5.4807 5.5508 5.5508 7.0143 7.0143 8.2047 8.2047 8.4745 8.4745 8.4862 8.4862 k = 0.0484 0.0279 0.0790 ( 12537 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0382 -12.0382 -10.9627 -10.9627 -10.9478 -10.9478 -10.9410 -10.9410 -10.6564 -10.6564 -10.6524 -10.6524 -7.8348 -7.8348 -7.4199 -7.4199 -7.3970 -7.3970 -6.5551 -6.5551 -6.5541 -6.5541 -6.5246 -6.5246 -6.5236 -6.5236 -1.9111 -1.9111 -1.6855 -1.6855 -1.6667 -1.6667 0.2243 0.2243 0.2339 0.2339 0.4304 0.4304 1.3093 1.3093 1.3589 1.3589 1.4036 1.4036 1.4741 1.4741 1.4838 1.4838 1.5206 1.5206 1.7326 1.7326 1.9046 1.9046 1.9231 1.9231 2.1921 2.1921 2.4079 2.4079 2.4172 2.4172 4.9679 4.9679 5.4795 5.4795 5.5251 5.5251 6.9791 6.9791 8.1794 8.1794 8.4527 8.4527 8.4610 8.4610 k = 0.0363 0.0210 0.0593 ( 12549 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0400 -12.0400 -10.9611 -10.9611 -10.9464 -10.9464 -10.9424 -10.9424 -10.6539 -10.6539 -10.6516 -10.6516 -7.8383 -7.8383 -7.4205 -7.4205 -7.3974 -7.3974 -6.5557 -6.5557 -6.5551 -6.5551 -6.5247 -6.5247 -6.5241 -6.5241 -1.9122 -1.9122 -1.6837 -1.6837 -1.6730 -1.6730 0.2236 0.2236 0.2291 0.2291 0.4265 0.4265 1.3369 1.3369 1.3837 1.3837 1.4100 1.4100 1.4704 1.4704 1.4876 1.4876 1.5091 1.5091 1.7371 1.7371 1.9051 1.9051 1.9161 1.9161 2.1957 2.1957 2.4193 2.4193 2.4247 2.4247 4.9588 4.9588 5.4789 5.4789 5.5049 5.5049 6.9514 6.9514 8.1594 8.1594 8.4357 8.4357 8.4408 8.4408 k = 0.0242 0.0140 0.0395 ( 12561 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0413 -12.0413 -10.9603 -10.9603 -10.9451 -10.9451 -10.9433 -10.9433 -10.6521 -10.6521 -10.6510 -10.6510 -7.8409 -7.8409 -7.4210 -7.4210 -7.3977 -7.3977 -6.5561 -6.5561 -6.5558 -6.5558 -6.5248 -6.5248 -6.5246 -6.5246 -1.9131 -1.9131 -1.6823 -1.6823 -1.6775 -1.6775 0.2231 0.2231 0.2256 0.2256 0.4238 0.4238 1.3625 1.3625 1.4024 1.4024 1.4146 1.4146 1.4603 1.4603 1.4913 1.4913 1.5006 1.5006 1.7404 1.7404 1.9056 1.9056 1.9106 1.9106 2.1987 2.1987 2.4277 2.4277 2.4302 2.4302 4.9517 4.9517 5.4787 5.4787 5.4904 5.4904 6.9314 6.9314 8.1450 8.1450 8.4236 8.4236 8.4259 8.4259 k = 0.0121 0.0070 0.0198 ( 12601 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0421 -12.0421 -10.9600 -10.9600 -10.9443 -10.9443 -10.9438 -10.9438 -10.6510 -10.6510 -10.6507 -10.6507 -7.8424 -7.8424 -7.4212 -7.4212 -7.3979 -7.3979 -6.5563 -6.5563 -6.5562 -6.5562 -6.5249 -6.5249 -6.5248 -6.5248 -1.9137 -1.9137 -1.6814 -1.6814 -1.6802 -1.6802 0.2228 0.2228 0.2234 0.2234 0.4222 0.4222 1.3850 1.3850 1.4133 1.4133 1.4170 1.4170 1.4475 1.4475 1.4935 1.4935 1.4957 1.4957 1.7424 1.7424 1.9059 1.9059 1.9072 1.9072 2.2007 2.2007 2.4329 2.4329 2.4335 2.4335 4.9471 4.9471 5.4787 5.4787 5.4816 5.4816 6.9193 6.9193 8.1363 8.1363 8.4162 8.4162 8.4168 8.4168 k = 0.0000 0.0000 0.0000 ( 12627 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0424 -12.0424 -10.9599 -10.9599 -10.9440 -10.9440 -10.9440 -10.9440 -10.6506 -10.6506 -10.6506 -10.6506 -7.8430 -7.8430 -7.4213 -7.4213 -7.3979 -7.3979 -6.5564 -6.5564 -6.5564 -6.5564 -6.5249 -6.5249 -6.5249 -6.5249 -1.9139 -1.9139 -1.6811 -1.6811 -1.6811 -1.6811 0.2227 0.2227 0.2227 0.2227 0.4217 0.4217 1.3972 1.3972 1.4162 1.4162 1.4162 1.4162 1.4410 1.4410 1.4942 1.4942 1.4942 1.4942 1.7431 1.7431 1.9060 1.9060 1.9060 1.9060 2.2014 2.2014 2.4347 2.4347 2.4347 2.4347 4.9455 4.9455 5.4787 5.4787 5.4787 5.4787 6.9153 6.9153 8.1334 8.1334 8.4138 8.4138 8.4138 8.4138 k = 0.0000 0.0000 0.0000 ( 12627 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0424 -12.0424 -10.9599 -10.9599 -10.9440 -10.9440 -10.9440 -10.9440 -10.6506 -10.6506 -10.6506 -10.6506 -7.8430 -7.8430 -7.4213 -7.4213 -7.3979 -7.3979 -6.5564 -6.5564 -6.5564 -6.5564 -6.5249 -6.5249 -6.5249 -6.5249 -1.9139 -1.9139 -1.6811 -1.6811 -1.6811 -1.6811 0.2227 0.2227 0.2227 0.2227 0.4217 0.4217 1.3972 1.3972 1.4162 1.4162 1.4162 1.4162 1.4410 1.4410 1.4942 1.4942 1.4942 1.4942 1.7431 1.7431 1.9060 1.9060 1.9060 1.9060 2.2014 2.2014 2.4347 2.4347 2.4347 2.4347 4.9455 4.9455 5.4787 5.4787 5.4787 5.4787 6.9153 6.9153 8.1334 8.1334 8.4138 8.4138 8.4138 8.4138 k = 0.0192 0.0111 0.0079 ( 12600 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0421 -12.0421 -10.9600 -10.9600 -10.9443 -10.9443 -10.9438 -10.9438 -10.6508 -10.6508 -10.6508 -10.6508 -7.8425 -7.8425 -7.4212 -7.4212 -7.3979 -7.3979 -6.5563 -6.5563 -6.5562 -6.5562 -6.5249 -6.5249 -6.5248 -6.5248 -1.9137 -1.9137 -1.6815 -1.6815 -1.6801 -1.6801 0.2229 0.2229 0.2233 0.2233 0.4222 0.4222 1.3857 1.3857 1.4135 1.4135 1.4167 1.4167 1.4475 1.4475 1.4934 1.4934 1.4957 1.4957 1.7425 1.7425 1.9064 1.9064 1.9067 1.9067 2.2007 2.2007 2.4332 2.4332 2.4333 2.4333 4.9470 4.9470 5.4784 5.4784 5.4816 5.4816 6.9191 6.9191 8.1361 8.1361 8.4164 8.4164 8.4164 8.4164 k = 0.0385 0.0222 0.0157 ( 12555 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0413 -12.0413 -10.9603 -10.9603 -10.9451 -10.9451 -10.9433 -10.9433 -10.6515 -10.6515 -10.6515 -10.6515 -7.8410 -7.8410 -7.4210 -7.4210 -7.3977 -7.3977 -6.5561 -6.5561 -6.5558 -6.5558 -6.5248 -6.5248 -6.5246 -6.5246 -1.9132 -1.9132 -1.6826 -1.6826 -1.6774 -1.6774 0.2236 0.2236 0.2249 0.2249 0.4237 0.4237 1.3647 1.3647 1.4054 1.4054 1.4101 1.4101 1.4618 1.4618 1.4911 1.4911 1.5000 1.5000 1.7405 1.7405 1.9075 1.9075 1.9085 1.9085 2.1989 2.1989 2.4291 2.4291 2.4294 2.4294 4.9513 4.9513 5.4779 5.4779 5.4905 5.4905 6.9306 6.9306 8.1444 8.1444 8.4241 8.4241 8.4243 8.4243 k = 0.0577 0.0333 0.0236 ( 12558 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0401 -12.0401 -10.9612 -10.9612 -10.9462 -10.9462 -10.9424 -10.9424 -10.6526 -10.6526 -10.6526 -10.6526 -7.8385 -7.8385 -7.4206 -7.4206 -7.3974 -7.3974 -6.5558 -6.5558 -6.5551 -6.5551 -6.5247 -6.5247 -6.5242 -6.5242 -1.9123 -1.9123 -1.6842 -1.6842 -1.6728 -1.6728 0.2247 0.2247 0.2277 0.2277 0.4262 0.4262 1.3408 1.3408 1.3924 1.3924 1.3974 1.3974 1.4762 1.4762 1.4870 1.4870 1.5068 1.5068 1.7375 1.7375 1.9093 1.9093 1.9116 1.9116 2.1960 2.1960 2.4222 2.4222 2.4231 2.4231 4.9579 4.9579 5.4774 5.4774 5.5051 5.5051 6.9495 6.9495 8.1580 8.1580 8.4367 8.4367 8.4371 8.4371 k = 0.0769 0.0444 0.0314 ( 12540 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0384 -12.0384 -10.9632 -10.9632 -10.9469 -10.9469 -10.9412 -10.9412 -10.6542 -10.6542 -10.6541 -10.6541 -7.8352 -7.8352 -7.4200 -7.4200 -7.3970 -7.3970 -6.5553 -6.5553 -6.5541 -6.5541 -6.5246 -6.5246 -6.5236 -6.5236 -1.9115 -1.9115 -1.6862 -1.6862 -1.6664 -1.6664 0.2262 0.2262 0.2316 0.2316 0.4298 0.4298 1.3153 1.3153 1.3750 1.3750 1.3804 1.3804 1.4807 1.4807 1.4874 1.4874 1.5164 1.5164 1.7335 1.7335 1.9116 1.9116 1.9157 1.9157 2.1925 2.1925 2.4130 2.4130 2.4145 2.4145 4.9661 4.9661 5.4775 5.4775 5.5252 5.5252 6.9758 6.9758 8.1769 8.1769 8.4541 8.4541 8.4549 8.4549 k = 0.0962 0.0555 0.0393 ( 12564 PWs) bands (ev): -22.7099 -22.7099 -22.7080 -22.7080 -12.0362 -12.0362 -10.9666 -10.9666 -10.9469 -10.9469 -10.9396 -10.9396 -10.6562 -10.6562 -10.6561 -10.6561 -7.8310 -7.8310 -7.4192 -7.4192 -7.3965 -7.3965 -6.5547 -6.5547 -6.5529 -6.5529 -6.5245 -6.5245 -6.5229 -6.5229 -1.9109 -1.9109 -1.6880 -1.6880 -1.6582 -1.6582 0.2280 0.2280 0.2365 0.2365 0.4346 0.4346 1.2884 1.2884 1.3538 1.3538 1.3599 1.3599 1.4722 1.4722 1.4948 1.4948 1.5278 1.5278 1.7291 1.7291 1.9145 1.9145 1.9208 1.9208 2.1890 2.1890 2.4015 2.4015 2.4038 2.4038 4.9747 4.9747 5.4790 5.4790 5.5503 5.5503 7.0091 7.0091 8.2007 8.2007 8.4760 8.4760 8.4771 8.4771 k = 0.1154 0.0666 0.0471 ( 12576 PWs) bands (ev): -22.7099 -22.7099 -22.7081 -22.7081 -12.0336 -12.0336 -10.9715 -10.9715 -10.9460 -10.9460 -10.9378 -10.9378 -10.6586 -10.6586 -10.6585 -10.6585 -7.8260 -7.8260 -7.4183 -7.4183 -7.3960 -7.3960 -6.5539 -6.5539 -6.5514 -6.5514 -6.5243 -6.5243 -6.5220 -6.5220 -1.9108 -1.9108 -1.6895 -1.6895 -1.6484 -1.6484 0.2302 0.2302 0.2424 0.2424 0.4405 0.4405 1.2602 1.2602 1.3292 1.3292 1.3362 1.3362 1.4613 1.4613 1.4990 1.4990 1.5392 1.5392 1.7251 1.7251 1.9178 1.9178 1.9262 1.9262 2.1862 2.1862 2.3880 2.3880 2.3914 2.3914 4.9825 4.9825 5.4827 5.4827 5.5799 5.5799 7.0491 7.0491 8.2291 8.2291 8.5019 8.5019 8.5035 8.5035 k = 0.1346 0.0777 0.0550 ( 12570 PWs) bands (ev): -22.7098 -22.7098 -22.7081 -22.7081 -12.0305 -12.0305 -10.9776 -10.9776 -10.9445 -10.9445 -10.9356 -10.9356 -10.6614 -10.6614 -10.6612 -10.6612 -7.8203 -7.8203 -7.4173 -7.4173 -7.3953 -7.3953 -6.5531 -6.5531 -6.5497 -6.5497 -6.5242 -6.5242 -6.5211 -6.5211 -1.9117 -1.9117 -1.6899 -1.6899 -1.6370 -1.6370 0.2327 0.2327 0.2492 0.2492 0.4477 0.4477 1.2308 1.2308 1.3017 1.3017 1.3098 1.3098 1.4480 1.4480 1.5002 1.5002 1.5495 1.5495 1.7223 1.7223 1.9215 1.9215 1.9313 1.9313 2.1852 2.1852 2.3730 2.3730 2.3776 2.3776 4.9881 4.9881 5.4897 5.4897 5.6136 5.6136 7.0955 7.0955 8.2618 8.2618 8.5314 8.5314 8.5336 8.5336 k = 0.1538 0.0888 0.0628 ( 12555 PWs) bands (ev): -22.7098 -22.7098 -22.7081 -22.7081 -12.0271 -12.0271 -10.9848 -10.9848 -10.9424 -10.9424 -10.9331 -10.9331 -10.6646 -10.6646 -10.6644 -10.6644 -7.8139 -7.8139 -7.4161 -7.4161 -7.3946 -7.3946 -6.5522 -6.5522 -6.5477 -6.5477 -6.5240 -6.5240 -6.5200 -6.5200 -1.9139 -1.9139 -1.6890 -1.6890 -1.6242 -1.6242 0.2354 0.2354 0.2569 0.2569 0.4562 0.4562 1.2003 1.2003 1.2718 1.2718 1.2810 1.2810 1.4325 1.4325 1.4980 1.4980 1.5581 1.5581 1.7216 1.7216 1.9255 1.9255 1.9352 1.9352 2.1869 2.1869 2.3567 2.3567 2.3625 2.3625 4.9904 4.9904 5.5008 5.5008 5.6508 5.6508 7.1478 7.1478 8.2981 8.2981 8.5642 8.5642 8.5669 8.5669 k = 0.1731 0.0999 0.0707 ( 12561 PWs) bands (ev): -22.7098 -22.7098 -22.7081 -22.7081 -12.0233 -12.0233 -10.9928 -10.9928 -10.9399 -10.9399 -10.9303 -10.9303 -10.6681 -10.6681 -10.6678 -10.6678 -7.8071 -7.8071 -7.4148 -7.4148 -7.3938 -7.3938 -6.5511 -6.5511 -6.5456 -6.5456 -6.5238 -6.5238 -6.5189 -6.5189 -1.9176 -1.9176 -1.6863 -1.6863 -1.6100 -1.6100 0.2385 0.2385 0.2654 0.2654 0.4660 0.4660 1.1688 1.1688 1.2400 1.2400 1.2500 1.2500 1.4148 1.4148 1.4915 1.4915 1.5656 1.5656 1.7235 1.7235 1.9297 1.9297 1.9370 1.9370 2.1924 2.1924 2.3395 2.3395 2.3466 2.3466 4.9884 4.9884 5.5165 5.5165 5.6907 5.6907 7.2055 7.2055 8.3374 8.3374 8.5997 8.5997 8.6031 8.6031 k = 0.1923 0.1110 0.0785 ( 12579 PWs) bands (ev): -22.7097 -22.7097 -22.7082 -22.7082 -12.0192 -12.0192 -11.0014 -11.0014 -10.9371 -10.9371 -10.9273 -10.9273 -10.6719 -10.6719 -10.6716 -10.6716 -7.7998 -7.7998 -7.4134 -7.4134 -7.3930 -7.3930 -6.5500 -6.5500 -6.5433 -6.5433 -6.5236 -6.5236 -6.5176 -6.5176 -1.9230 -1.9230 -1.6816 -1.6816 -1.5945 -1.5945 0.2418 0.2418 0.2745 0.2745 0.4772 0.4772 1.1365 1.1365 1.2069 1.2069 1.2175 1.2175 1.3950 1.3950 1.4802 1.4802 1.5726 1.5726 1.7282 1.7282 1.9341 1.9341 1.9360 1.9360 2.2023 2.2023 2.3217 2.3217 2.3303 2.3303 4.9815 4.9815 5.5369 5.5369 5.7328 5.7328 7.2681 7.2681 8.3788 8.3788 8.6376 8.6376 8.6416 8.6416 k = 0.2115 0.1221 0.0864 ( 12582 PWs) bands (ev): -22.7097 -22.7097 -22.7082 -22.7082 -12.0149 -12.0149 -11.0105 -11.0105 -10.9340 -10.9340 -10.9240 -10.9240 -10.6760 -10.6760 -10.6757 -10.6757 -7.7923 -7.7923 -7.4119 -7.4119 -7.3921 -7.3921 -6.5487 -6.5487 -6.5409 -6.5409 -6.5235 -6.5235 -6.5164 -6.5164 -1.9300 -1.9300 -1.6750 -1.6750 -1.5780 -1.5780 0.2453 0.2453 0.2841 0.2841 0.4897 0.4897 1.1034 1.1034 1.1730 1.1730 1.1837 1.1837 1.3734 1.3734 1.4639 1.4639 1.5798 1.5798 1.7352 1.7352 1.9318 1.9318 1.9388 1.9388 2.2160 2.2160 2.3034 2.3034 2.3142 2.3142 4.9699 4.9699 5.5616 5.5616 5.7765 5.7765 7.3353 7.3353 8.4215 8.4215 8.6774 8.6774 8.6822 8.6822 k = 0.2308 0.1332 0.0942 ( 12575 PWs) bands (ev): -22.7097 -22.7097 -22.7082 -22.7082 -12.0104 -12.0104 -11.0200 -11.0200 -10.9306 -10.9306 -10.9205 -10.9205 -10.6804 -10.6804 -10.6799 -10.6799 -7.7846 -7.7846 -7.4103 -7.4103 -7.3913 -7.3913 -6.5475 -6.5475 -6.5384 -6.5384 -6.5234 -6.5234 -6.5151 -6.5151 -1.9385 -1.9385 -1.6664 -1.6664 -1.5607 -1.5607 0.2492 0.2492 0.2941 0.2941 0.5034 0.5034 1.0698 1.0698 1.1389 1.1389 1.1493 1.1493 1.3501 1.3501 1.4432 1.4432 1.5876 1.5876 1.7441 1.7441 1.9248 1.9248 1.9435 1.9435 2.2312 2.2312 2.2851 2.2851 2.3006 2.3006 4.9539 4.9539 5.5901 5.5901 5.8210 5.8210 7.4063 7.4063 8.4643 8.4643 8.7190 8.7190 8.7244 8.7244 k = 0.2500 0.1443 0.1021 ( 12590 PWs) bands (ev): -22.7096 -22.7096 -22.7083 -22.7083 -12.0057 -12.0057 -11.0297 -11.0297 -10.9270 -10.9270 -10.9169 -10.9169 -10.6849 -10.6849 -10.6844 -10.6844 -7.7768 -7.7768 -7.4086 -7.4086 -7.3904 -7.3904 -6.5461 -6.5461 -6.5358 -6.5358 -6.5233 -6.5233 -6.5138 -6.5138 -1.9482 -1.9482 -1.6562 -1.6562 -1.5426 -1.5426 0.2535 0.2535 0.3042 0.3042 0.5184 0.5184 1.0359 1.0359 1.1052 1.1052 1.1147 1.1147 1.3253 1.3253 1.4189 1.4189 1.5959 1.5959 1.7545 1.7545 1.9153 1.9153 1.9485 1.9485 2.2404 2.2404 2.2669 2.2669 2.2964 2.2964 4.9341 4.9341 5.6213 5.6213 5.8658 5.8658 7.4806 7.4806 8.5059 8.5059 8.7619 8.7619 8.7680 8.7680 k = 0.2692 0.1554 0.1099 ( 12596 PWs) bands (ev): -22.7096 -22.7096 -22.7083 -22.7083 -12.0009 -12.0009 -11.0394 -11.0394 -10.9233 -10.9233 -10.9131 -10.9131 -10.6895 -10.6895 -10.6890 -10.6890 -7.7690 -7.7690 -7.4069 -7.4069 -7.3895 -7.3895 -6.5447 -6.5447 -6.5332 -6.5332 -6.5233 -6.5233 -6.5126 -6.5126 -1.9587 -1.9587 -1.6447 -1.6447 -1.5242 -1.5242 0.2581 0.2581 0.3143 0.3143 0.5344 0.5344 1.0021 1.0021 1.0726 1.0726 1.0805 1.0805 1.2993 1.2993 1.3915 1.3915 1.6047 1.6047 1.7659 1.7659 1.9042 1.9042 1.9536 1.9536 2.2344 2.2344 2.2489 2.2489 2.3099 2.3099 4.9114 4.9114 5.6543 5.6543 5.9102 5.9102 7.5577 7.5577 8.5448 8.5448 8.8061 8.8061 8.8127 8.8127 k = 0.2885 0.1665 0.1178 ( 12596 PWs) bands (ev): -22.7095 -22.7095 -22.7083 -22.7083 -11.9962 -11.9962 -11.0491 -11.0491 -10.9195 -10.9195 -10.9092 -10.9092 -10.6943 -10.6943 -10.6937 -10.6937 -7.7615 -7.7615 -7.4052 -7.4052 -7.3887 -7.3887 -6.5433 -6.5433 -6.5306 -6.5306 -6.5233 -6.5233 -6.5114 -6.5114 -1.9697 -1.9697 -1.6322 -1.6322 -1.5055 -1.5055 0.2631 0.2631 0.3240 0.3240 0.5512 0.5512 0.9685 0.9685 1.0417 1.0417 1.0475 1.0475 1.2723 1.2723 1.3619 1.3619 1.6140 1.6140 1.7782 1.7782 1.8918 1.8918 1.9589 1.9589 2.2190 2.2190 2.2314 2.2314 2.3343 2.3343 4.8866 4.8866 5.6880 5.6880 5.9535 5.9535 7.6368 7.6368 8.5796 8.5796 8.8513 8.8513 8.8585 8.8585 k = 0.3077 0.1776 0.1256 ( 12605 PWs) bands (ev): -22.7095 -22.7095 -22.7084 -22.7084 -11.9914 -11.9914 -11.0586 -11.0586 -10.9156 -10.9156 -10.9052 -10.9052 -10.6990 -10.6990 -10.6985 -10.6985 -7.7542 -7.7542 -7.4035 -7.4035 -7.3879 -7.3879 -6.5418 -6.5418 -6.5280 -6.5280 -6.5234 -6.5234 -6.5103 -6.5103 -1.9808 -1.9808 -1.6191 -1.6191 -1.4870 -1.4870 0.2685 0.2685 0.3332 0.3332 0.5686 0.5686 0.9355 0.9355 1.0133 1.0133 1.0163 1.0163 1.2446 1.2446 1.3305 1.3305 1.6238 1.6238 1.7910 1.7910 1.8789 1.8789 1.9643 1.9643 2.2005 2.2005 2.2146 2.2146 2.3628 2.3628 4.8605 4.8605 5.7217 5.7217 5.9953 5.9953 7.7175 7.7175 8.6089 8.6089 8.8974 8.8974 8.9050 8.9050 k = 0.3269 0.1887 0.1335 ( 12590 PWs) bands (ev): -22.7094 -22.7094 -22.7084 -22.7084 -11.9869 -11.9869 -11.0677 -11.0677 -10.9117 -10.9117 -10.9012 -10.9012 -10.7037 -10.7037 -10.7032 -10.7032 -7.7473 -7.7473 -7.4018 -7.4018 -7.3872 -7.3872 -6.5404 -6.5404 -6.5254 -6.5254 -6.5235 -6.5235 -6.5092 -6.5092 -1.9918 -1.9918 -1.6058 -1.6058 -1.4688 -1.4688 0.2743 0.2743 0.3415 0.3415 0.5861 0.5861 0.9034 0.9034 0.9877 0.9877 0.9880 0.9880 1.2165 1.2165 1.2978 1.2978 1.6339 1.6339 1.8039 1.8039 1.8660 1.8660 1.9698 1.9698 2.1807 2.1807 2.1984 2.1984 2.3925 2.3925 4.8339 4.8339 5.7545 5.7545 6.0349 6.0349 7.7989 7.7989 8.6314 8.6314 8.9442 8.9442 8.9522 8.9522 k = 0.3462 0.1999 0.1413 ( 12617 PWs) bands (ev): -22.7094 -22.7094 -22.7085 -22.7085 -11.9825 -11.9825 -11.0763 -11.0763 -10.9079 -10.9079 -10.8974 -10.8974 -10.7083 -10.7083 -10.7077 -10.7077 -7.7408 -7.7408 -7.4002 -7.4002 -7.3865 -7.3865 -6.5389 -6.5389 -6.5237 -6.5237 -6.5230 -6.5230 -6.5084 -6.5084 -2.0023 -2.0023 -1.5927 -1.5927 -1.4513 -1.4513 0.2804 0.2804 0.3487 0.3487 0.6034 0.6034 0.8727 0.8727 0.9627 0.9627 0.9665 0.9665 1.1882 1.1882 1.2644 1.2644 1.6443 1.6443 1.8158 1.8158 1.8546 1.8546 1.9755 1.9755 2.1603 2.1603 2.1830 2.1830 2.4220 2.4220 4.8075 4.8075 5.7857 5.7857 6.0719 6.0719 7.8803 7.8803 8.6463 8.6463 8.9915 8.9915 8.9998 8.9998 k = 0.3654 0.2110 0.1492 ( 12626 PWs) bands (ev): -22.7093 -22.7093 -22.7085 -22.7085 -11.9784 -11.9784 -11.0843 -11.0843 -10.9042 -10.9042 -10.8936 -10.8936 -10.7127 -10.7127 -10.7121 -10.7121 -7.7349 -7.7349 -7.3986 -7.3986 -7.3859 -7.3859 -6.5375 -6.5375 -6.5240 -6.5240 -6.5206 -6.5206 -6.5076 -6.5076 -2.0122 -2.0122 -1.5801 -1.5801 -1.4348 -1.4348 0.2867 0.2867 0.3546 0.3546 0.6196 0.6196 0.8436 0.8436 0.9422 0.9422 0.9492 0.9492 1.1601 1.1601 1.2305 1.2305 1.6550 1.6550 1.8212 1.8212 1.8502 1.8502 1.9812 1.9812 2.1398 2.1398 2.1686 2.1686 2.4504 2.4504 4.7821 4.7821 5.8146 5.8146 6.1058 6.1058 7.9611 7.9611 8.6530 8.6530 9.0390 9.0390 9.0476 9.0476 k = 0.3846 0.2221 0.1570 ( 12608 PWs) bands (ev): -22.7093 -22.7093 -22.7086 -22.7086 -11.9747 -11.9747 -11.0915 -11.0915 -10.9007 -10.9007 -10.8901 -10.8901 -10.7168 -10.7168 -10.7162 -10.7162 -7.7297 -7.7297 -7.3972 -7.3972 -7.3854 -7.3854 -6.5361 -6.5361 -6.5244 -6.5244 -6.5184 -6.5184 -6.5070 -6.5070 -2.0211 -2.0211 -1.5684 -1.5684 -1.4196 -1.4196 0.2930 0.2930 0.3591 0.3591 0.6342 0.6342 0.8167 0.8167 0.9271 0.9271 0.9365 0.9365 1.1326 1.1326 1.1968 1.1968 1.6658 1.6658 1.8145 1.8145 1.8585 1.8585 1.9870 1.9870 2.1192 2.1192 2.1553 2.1553 2.4769 2.4769 4.7584 4.7584 5.8408 5.8408 6.1360 6.1360 8.0403 8.0403 8.6513 8.6513 9.0862 9.0862 9.0950 9.0950 k = 0.4038 0.2332 0.1649 ( 12623 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9714 -11.9714 -11.0978 -11.0978 -10.8976 -10.8976 -10.8869 -10.8869 -10.7205 -10.7205 -10.7199 -10.7199 -7.7251 -7.7251 -7.3959 -7.3959 -7.3850 -7.3850 -6.5348 -6.5348 -6.5249 -6.5249 -6.5164 -6.5164 -6.5066 -6.5066 -2.0290 -2.0290 -1.5579 -1.5579 -1.4062 -1.4062 0.2992 0.2992 0.3622 0.3622 0.6463 0.6463 0.7923 0.7923 0.9183 0.9183 0.9284 0.9284 1.1061 1.1061 1.1637 1.1637 1.6769 1.6769 1.8028 1.8028 1.8722 1.8722 1.9926 1.9926 2.0991 2.0991 2.1431 2.1431 2.5007 2.5007 4.7370 4.7370 5.8637 5.8637 6.1623 6.1623 8.1172 8.1172 8.6413 8.6413 9.1325 9.1325 9.1415 9.1415 k = 0.4231 0.2443 0.1727 ( 12617 PWs) bands (ev): -22.7092 -22.7092 -22.7087 -22.7087 -11.9686 -11.9686 -11.1031 -11.1031 -10.8948 -10.8948 -10.8840 -10.8840 -10.7237 -10.7237 -10.7232 -10.7232 -7.7213 -7.7213 -7.3948 -7.3948 -7.3847 -7.3847 -6.5334 -6.5334 -6.5255 -6.5255 -6.5146 -6.5146 -6.5063 -6.5063 -2.0356 -2.0356 -1.5489 -1.5489 -1.3946 -1.3946 0.3050 0.3050 0.3642 0.3642 0.6556 0.6556 0.7710 0.7710 0.9161 0.9161 0.9248 0.9248 1.0813 1.0813 1.1318 1.1318 1.6881 1.6881 1.7901 1.7901 1.8872 1.8872 1.9980 1.9980 2.0796 2.0796 2.1324 2.1324 2.5211 2.5211 4.7186 4.7186 5.8830 5.8830 6.1843 6.1843 8.1906 8.1906 8.6235 8.6235 9.1770 9.1770 9.1860 9.1860 k = 0.4423 0.2554 0.1806 ( 12608 PWs) bands (ev): -22.7091 -22.7091 -22.7088 -22.7088 -11.9664 -11.9664 -11.1073 -11.1073 -10.8926 -10.8926 -10.8817 -10.8817 -10.7263 -10.7263 -10.7258 -10.7258 -7.7183 -7.7183 -7.3939 -7.3939 -7.3845 -7.3845 -6.5322 -6.5322 -6.5262 -6.5262 -6.5131 -6.5131 -6.5062 -6.5062 -2.0409 -2.0409 -1.5415 -1.5415 -1.3854 -1.3854 0.3100 0.3100 0.3652 0.3652 0.6622 0.6622 0.7533 0.7533 0.9199 0.9199 0.9250 0.9250 1.0589 1.0589 1.1021 1.1021 1.6994 1.6994 1.7774 1.7774 1.9021 1.9021 2.0028 2.0028 2.0615 2.0615 2.1234 2.1234 2.5377 2.5377 4.7037 4.7037 5.8983 5.8983 6.2018 6.2018 8.2594 8.2594 8.5985 8.5985 9.2179 9.2179 9.2270 9.2270 k = 0.4615 0.2665 0.1884 ( 12611 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9648 -11.9648 -11.1104 -11.1104 -10.8909 -10.8909 -10.8800 -10.8800 -10.7282 -10.7282 -10.7278 -10.7278 -7.7161 -7.7161 -7.3932 -7.3932 -7.3843 -7.3843 -6.5310 -6.5310 -6.5269 -6.5269 -6.5118 -6.5118 -6.5063 -6.5063 -2.0447 -2.0447 -1.5362 -1.5362 -1.3786 -1.3786 0.3138 0.3138 0.3656 0.3656 0.6663 0.6663 0.7398 0.7398 0.9280 0.9280 0.9280 0.9280 1.0402 1.0402 1.0761 1.0761 1.7106 1.7106 1.7651 1.7651 1.9156 1.9156 2.0067 2.0067 2.0458 2.0458 2.1165 2.1165 2.5498 2.5498 4.6927 4.6927 5.9094 5.9094 6.2144 6.2144 8.3213 8.3213 8.5682 8.5682 9.2525 9.2525 9.2618 9.2618 k = 0.4808 0.2776 0.1963 ( 12614 PWs) bands (ev): -22.7090 -22.7090 -22.7089 -22.7089 -11.9638 -11.9638 -11.1123 -11.1123 -10.8899 -10.8899 -10.8789 -10.8789 -10.7294 -10.7294 -10.7290 -10.7290 -7.7148 -7.7148 -7.3928 -7.3928 -7.3842 -7.3842 -6.5300 -6.5300 -6.5277 -6.5277 -6.5110 -6.5110 -6.5064 -6.5064 -2.0470 -2.0470 -1.5329 -1.5329 -1.3744 -1.3744 0.3163 0.3163 0.3658 0.3658 0.6687 0.6687 0.7313 0.7313 0.9316 0.9316 0.9367 0.9367 1.0272 1.0272 1.0570 1.0570 1.7210 1.7210 1.7541 1.7541 1.9257 1.9257 2.0093 2.0093 2.0343 2.0343 2.1121 2.1121 2.5572 2.5572 4.6859 4.6859 5.9161 5.9161 6.2220 6.2220 8.3714 8.3714 8.5372 8.5372 9.2767 9.2767 9.2861 9.2861 k = 0.5000 0.2887 0.2041 ( 12662 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9635 -11.9635 -11.1129 -11.1129 -10.8895 -10.8895 -10.8786 -10.8786 -10.7298 -10.7298 -10.7294 -10.7294 -7.7144 -7.7144 -7.3926 -7.3926 -7.3842 -7.3842 -6.5293 -6.5293 -6.5283 -6.5283 -6.5107 -6.5107 -6.5065 -6.5065 -2.0478 -2.0478 -1.5318 -1.5318 -1.3730 -1.3730 0.3172 0.3172 0.3658 0.3658 0.6694 0.6694 0.7283 0.7283 0.9333 0.9333 0.9407 0.9407 1.0223 1.0223 1.0496 1.0496 1.7265 1.7265 1.7482 1.7482 1.9296 1.9296 2.0102 2.0102 2.0300 2.0300 2.1105 2.1105 2.5597 2.5597 4.6837 4.6837 5.9184 5.9184 6.2246 6.2246 8.3939 8.3939 8.5210 8.5210 9.2856 9.2856 9.2951 9.2951 k = 0.5000 0.2887 0.2041 ( 12662 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9635 -11.9635 -11.1129 -11.1129 -10.8895 -10.8895 -10.8786 -10.8786 -10.7298 -10.7298 -10.7294 -10.7294 -7.7144 -7.7144 -7.3926 -7.3926 -7.3842 -7.3842 -6.5293 -6.5293 -6.5283 -6.5283 -6.5107 -6.5107 -6.5065 -6.5065 -2.0478 -2.0478 -1.5318 -1.5318 -1.3730 -1.3730 0.3172 0.3172 0.3658 0.3658 0.6694 0.6694 0.7283 0.7283 0.9333 0.9333 0.9407 0.9407 1.0223 1.0223 1.0496 1.0496 1.7265 1.7265 1.7482 1.7482 1.9296 1.9296 2.0102 2.0102 2.0300 2.0300 2.1105 2.1105 2.5597 2.5597 4.6837 4.6837 5.9184 5.9184 6.2246 6.2246 8.3939 8.3939 8.5210 8.5210 9.2856 9.2856 9.2951 9.2951 k = 0.5069 0.2686 0.2155 ( 12611 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9633 -11.9633 -11.1126 -11.1126 -10.8899 -10.8899 -10.8790 -10.8790 -10.7298 -10.7298 -10.7293 -10.7293 -7.7141 -7.7141 -7.3926 -7.3926 -7.3841 -7.3841 -6.5292 -6.5292 -6.5282 -6.5282 -6.5107 -6.5107 -6.5064 -6.5064 -2.0467 -2.0467 -1.5322 -1.5322 -1.3736 -1.3736 0.3173 0.3173 0.3657 0.3657 0.6673 0.6673 0.7298 0.7298 0.9195 0.9195 0.9560 0.9560 1.0173 1.0173 1.0562 1.0562 1.7238 1.7238 1.7476 1.7476 1.9285 1.9285 2.0063 2.0063 2.0313 2.0313 2.1088 2.1088 2.5615 2.5615 4.6879 4.6879 5.9177 5.9177 6.2236 6.2236 8.3974 8.3974 8.5242 8.5242 9.2882 9.2882 9.2980 9.2980 k = 0.5139 0.2486 0.2268 ( 12606 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9629 -11.9629 -11.1117 -11.1117 -10.8911 -10.8911 -10.8802 -10.8802 -10.7301 -10.7301 -10.7286 -10.7286 -7.7134 -7.7134 -7.3925 -7.3925 -7.3839 -7.3839 -6.5290 -6.5290 -6.5279 -6.5279 -6.5107 -6.5107 -6.5064 -6.5064 -2.0433 -2.0433 -1.5336 -1.5336 -1.3753 -1.3753 0.3176 0.3176 0.3654 0.3654 0.6617 0.6617 0.7335 0.7335 0.9045 0.9045 0.9753 0.9753 1.0086 1.0086 1.0698 1.0698 1.7160 1.7160 1.7451 1.7451 1.9253 1.9253 1.9967 1.9967 2.0333 2.0333 2.1040 2.1040 2.5667 2.5667 4.7006 4.7006 5.9157 5.9157 6.2209 6.2209 8.4078 8.4078 8.5335 8.5335 9.2945 9.2945 9.3078 9.3078 k = 0.5208 0.2285 0.2381 ( 12602 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9623 -11.9623 -11.1102 -11.1102 -10.8931 -10.8931 -10.8820 -10.8820 -10.7308 -10.7308 -10.7273 -10.7273 -7.7123 -7.7123 -7.3924 -7.3924 -7.3836 -7.3836 -6.5287 -6.5287 -6.5275 -6.5275 -6.5107 -6.5107 -6.5064 -6.5064 -2.0377 -2.0377 -1.5359 -1.5359 -1.3781 -1.3781 0.3180 0.3180 0.3649 0.3649 0.6543 0.6543 0.7373 0.7373 0.8917 0.8917 0.9925 0.9925 1.0035 1.0035 1.0860 1.0860 1.7040 1.7040 1.7402 1.7402 1.9194 1.9194 1.9836 1.9836 2.0339 2.0339 2.0970 2.0970 2.5752 2.5752 4.7213 4.7213 5.9124 5.9124 6.2164 6.2164 8.4250 8.4250 8.5490 8.5490 9.3030 9.3030 9.3260 9.3260 k = 0.5278 0.2085 0.2495 ( 12606 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9614 -11.9614 -11.1080 -11.1080 -10.8960 -10.8960 -10.8844 -10.8844 -10.7317 -10.7317 -10.7256 -10.7256 -7.7107 -7.7107 -7.3922 -7.3922 -7.3832 -7.3832 -6.5281 -6.5281 -6.5270 -6.5270 -6.5106 -6.5106 -6.5064 -6.5064 -2.0301 -2.0301 -1.5391 -1.5391 -1.3820 -1.3820 0.3181 0.3181 0.3644 0.3644 0.6465 0.6465 0.7400 0.7400 0.8817 0.8817 0.9913 0.9913 1.0194 1.0194 1.1036 1.1036 1.6884 1.6884 1.7324 1.7324 1.9101 1.9101 1.9683 1.9683 2.0318 2.0318 2.0894 2.0894 2.5865 2.5865 4.7494 4.7494 5.9077 5.9077 6.2102 6.2102 8.4489 8.4489 8.5705 8.5705 9.3132 9.3132 9.3522 9.3522 k = 0.5347 0.1884 0.2608 ( 12607 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9602 -11.9602 -11.1053 -11.1053 -10.8997 -10.8997 -10.8872 -10.8872 -10.7329 -10.7329 -10.7235 -10.7235 -7.7088 -7.7088 -7.3919 -7.3919 -7.3826 -7.3826 -6.5275 -6.5275 -6.5263 -6.5263 -6.5106 -6.5106 -6.5063 -6.5063 -2.0204 -2.0204 -1.5430 -1.5430 -1.3868 -1.3868 0.3174 0.3174 0.3640 0.3640 0.6391 0.6391 0.7404 0.7404 0.8748 0.8748 0.9875 0.9875 1.0407 1.0407 1.1223 1.1223 1.6694 1.6694 1.7218 1.7218 1.8967 1.8967 1.9519 1.9519 2.0258 2.0258 2.0835 2.0835 2.6002 2.6002 4.7839 4.7839 5.9018 5.9018 6.2024 6.2024 8.4790 8.4790 8.5978 8.5978 9.3252 9.3252 9.3857 9.3857 k = 0.5417 0.1684 0.2722 ( 12599 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9589 -11.9589 -11.1020 -11.1020 -10.9043 -10.9043 -10.8902 -10.8902 -10.7345 -10.7345 -10.7210 -10.7210 -7.7065 -7.7065 -7.3916 -7.3916 -7.3820 -7.3820 -6.5268 -6.5268 -6.5256 -6.5256 -6.5106 -6.5106 -6.5063 -6.5063 -2.0089 -2.0089 -1.5477 -1.5477 -1.3923 -1.3923 0.3153 0.3153 0.3641 0.3641 0.6324 0.6324 0.7385 0.7385 0.8707 0.8707 0.9864 0.9864 1.0625 1.0625 1.1418 1.1418 1.6473 1.6473 1.7084 1.7084 1.8785 1.8785 1.9351 1.9351 2.0154 2.0154 2.0809 2.0809 2.6160 2.6160 4.8240 4.8240 5.8949 5.8949 6.1932 6.1932 8.5152 8.5152 8.6307 8.6307 9.3381 9.3381 9.4262 9.4262 k = 0.5486 0.1483 0.2835 ( 12591 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9574 -11.9574 -11.0982 -11.0982 -10.9095 -10.9095 -10.8935 -10.8935 -10.7365 -10.7365 -10.7182 -10.7182 -7.7039 -7.7039 -7.3913 -7.3913 -7.3812 -7.3812 -6.5259 -6.5259 -6.5247 -6.5247 -6.5105 -6.5105 -6.5062 -6.5062 -1.9958 -1.9958 -1.5529 -1.5529 -1.3986 -1.3986 0.3113 0.3113 0.3651 0.3651 0.6266 0.6266 0.7349 0.7349 0.8688 0.8688 0.9885 0.9885 1.0843 1.0843 1.1618 1.1618 1.6224 1.6224 1.6926 1.6926 1.8558 1.8558 1.9184 1.9184 2.0013 2.0013 2.0819 2.0819 2.6331 2.6331 4.8684 4.8684 5.8869 5.8869 6.1828 6.1828 8.5569 8.5569 8.6687 8.6687 9.3513 9.3513 9.4731 9.4731 k = 0.5556 0.1283 0.2948 ( 12592 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9558 -11.9558 -11.0939 -11.0939 -10.9153 -10.9153 -10.8969 -10.8969 -10.7389 -10.7389 -10.7151 -10.7151 -7.7012 -7.7012 -7.3909 -7.3909 -7.3804 -7.3804 -6.5250 -6.5250 -6.5237 -6.5237 -6.5105 -6.5105 -6.5061 -6.5061 -1.9813 -1.9813 -1.5586 -1.5586 -1.4054 -1.4054 0.3049 0.3049 0.3670 0.3670 0.6211 0.6211 0.7310 0.7310 0.8685 0.8685 0.9942 0.9942 1.1058 1.1058 1.1822 1.1822 1.5951 1.5951 1.6745 1.6745 1.8294 1.8294 1.9016 1.9016 1.9849 1.9849 2.0855 2.0855 2.6513 2.6513 4.9161 4.9161 5.8783 5.8783 6.1712 6.1712 8.6037 8.6037 8.7115 8.7115 9.3639 9.3639 9.5260 9.5260 k = 0.5625 0.1083 0.3062 ( 12612 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9540 -11.9540 -11.0891 -11.0891 -10.9216 -10.9216 -10.9004 -10.9004 -10.7418 -10.7418 -10.7118 -10.7118 -7.6982 -7.6982 -7.3905 -7.3905 -7.3796 -7.3796 -6.5241 -6.5241 -6.5228 -6.5228 -6.5105 -6.5105 -6.5060 -6.5060 -1.9658 -1.9658 -1.5645 -1.5645 -1.4126 -1.4126 0.2962 0.2962 0.3699 0.3699 0.6153 0.6153 0.7283 0.7283 0.8693 0.8693 1.0033 1.0033 1.1267 1.1267 1.2027 1.2027 1.5657 1.5657 1.6546 1.6546 1.8005 1.8005 1.8847 1.8847 1.9672 1.9672 2.0910 2.0910 2.6701 2.6701 4.9656 4.9656 5.8692 5.8692 6.1587 6.1587 8.6547 8.6547 8.7586 8.7586 9.3747 9.3747 9.5843 9.5843 k = 0.5694 0.0882 0.3175 ( 12608 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9522 -11.9522 -11.0839 -11.0839 -10.9280 -10.9280 -10.9039 -10.9039 -10.7450 -10.7450 -10.7084 -10.7084 -7.6952 -7.6952 -7.3901 -7.3901 -7.3787 -7.3787 -6.5231 -6.5231 -6.5218 -6.5218 -6.5105 -6.5105 -6.5058 -6.5058 -1.9495 -1.9495 -1.5704 -1.5704 -1.4200 -1.4200 0.2855 0.2855 0.3733 0.3733 0.6083 0.6083 0.7284 0.7284 0.8709 0.8709 1.0155 1.0155 1.1467 1.1467 1.2229 1.2229 1.5348 1.5348 1.6332 1.6332 1.7701 1.7701 1.8679 1.8679 1.9488 1.9488 2.0980 2.0980 2.6889 2.6889 5.0157 5.0157 5.8601 5.8601 6.1455 6.1455 8.7093 8.7093 8.8095 8.8095 9.3828 9.3828 9.6471 9.6471 k = 0.5764 0.0682 0.3289 ( 12612 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9504 -11.9504 -11.0783 -11.0783 -10.9344 -10.9344 -10.9076 -10.9076 -10.7486 -10.7486 -10.7048 -10.7048 -7.6921 -7.6921 -7.3898 -7.3898 -7.3779 -7.3779 -6.5222 -6.5222 -6.5208 -6.5208 -6.5105 -6.5105 -6.5056 -6.5056 -1.9330 -1.9330 -1.5760 -1.5760 -1.4276 -1.4276 0.2733 0.2733 0.3768 0.3768 0.5997 0.5997 0.7321 0.7321 0.8735 0.8735 1.0304 1.0304 1.1656 1.1656 1.2423 1.2423 1.5033 1.5033 1.6108 1.6108 1.7389 1.7389 1.8515 1.8515 1.9299 1.9299 2.1061 2.1061 2.7075 2.7075 5.0651 5.0651 5.8516 5.8516 6.1316 6.1316 8.7665 8.7665 8.8636 8.8636 9.3870 9.3870 9.7038 9.7038 k = 0.5833 0.0481 0.3402 ( 12596 PWs) bands (ev): -22.7090 -22.7090 -22.7089 -22.7089 -11.9486 -11.9486 -11.0725 -11.0725 -10.9407 -10.9407 -10.9112 -10.9112 -10.7527 -10.7527 -10.7012 -10.7012 -7.6891 -7.6891 -7.3894 -7.3894 -7.3770 -7.3770 -6.5212 -6.5212 -6.5199 -6.5199 -6.5105 -6.5105 -6.5053 -6.5053 -1.9166 -1.9166 -1.5809 -1.5809 -1.4353 -1.4353 0.2600 0.2600 0.3798 0.3798 0.5900 0.5900 0.7397 0.7397 0.8772 0.8772 1.0474 1.0474 1.1830 1.1830 1.2602 1.2602 1.4719 1.4719 1.5882 1.5882 1.7079 1.7079 1.8356 1.8356 1.9109 1.9109 2.1150 2.1150 2.7253 2.7253 5.1123 5.1123 5.8443 5.8443 6.1174 6.1174 8.8249 8.8249 8.9202 8.9202 9.3866 9.3866 9.7260 9.7260 k = 0.5903 0.0281 0.3515 ( 12600 PWs) bands (ev): -22.7090 -22.7090 -22.7089 -22.7089 -11.9469 -11.9469 -11.0665 -11.0665 -10.9466 -10.9466 -10.9148 -10.9148 -10.7571 -10.7571 -10.6975 -10.6975 -7.6863 -7.6863 -7.3891 -7.3891 -7.3762 -7.3762 -6.5204 -6.5204 -6.5190 -6.5190 -6.5105 -6.5105 -6.5050 -6.5050 -1.9010 -1.9010 -1.5850 -1.5850 -1.4428 -1.4428 0.2461 0.2461 0.3816 0.3816 0.5802 0.5802 0.7507 0.7507 0.8824 0.8824 1.0660 1.0660 1.1984 1.1984 1.2750 1.2750 1.4426 1.4426 1.5660 1.5660 1.6778 1.6778 1.8203 1.8203 1.8920 1.8920 2.1247 2.1247 2.7421 2.7421 5.1560 5.1560 5.8387 5.8387 6.1028 6.1028 8.8832 8.8832 8.9784 8.9784 9.3806 9.3806 9.7490 9.7490 k = 0.5972 0.0080 0.3629 ( 12592 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9454 -11.9454 -11.0605 -11.0605 -10.9519 -10.9519 -10.9184 -10.9184 -10.7619 -10.7619 -10.6939 -10.6939 -7.6836 -7.6836 -7.3888 -7.3888 -7.3754 -7.3754 -6.5197 -6.5197 -6.5182 -6.5182 -6.5106 -6.5106 -6.5045 -6.5045 -1.8867 -1.8867 -1.5879 -1.5879 -1.4500 -1.4500 0.2318 0.2318 0.3813 0.3813 0.5717 0.5717 0.7643 0.7643 0.8891 0.8891 1.0857 1.0857 1.2115 1.2115 1.2842 1.2842 1.4181 1.4181 1.5448 1.5448 1.6496 1.6496 1.8057 1.8057 1.8734 1.8734 2.1349 2.1349 2.7573 2.7573 5.1949 5.1949 5.8354 5.8354 6.0883 6.0883 8.9394 8.9394 9.0371 9.0371 9.3689 9.3689 9.7728 9.7728 k = 0.6042-0.0120 0.3742 ( 12594 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9440 -11.9440 -11.0546 -11.0546 -10.9564 -10.9564 -10.9219 -10.9219 -10.7669 -10.7669 -10.6902 -10.6902 -7.6813 -7.6813 -7.3885 -7.3885 -7.3747 -7.3747 -6.5191 -6.5191 -6.5176 -6.5176 -6.5107 -6.5107 -6.5041 -6.5041 -1.8740 -1.8740 -1.5895 -1.5895 -1.4567 -1.4567 0.2176 0.2176 0.3783 0.3783 0.5660 0.5660 0.7798 0.7798 0.8977 0.8977 1.1057 1.1057 1.2216 1.2216 1.2836 1.2836 1.4029 1.4029 1.5255 1.5255 1.6244 1.6244 1.7917 1.7917 1.8555 1.8555 2.1455 2.1455 2.7707 2.7707 5.2281 5.2281 5.8348 5.8348 6.0740 6.0740 8.9912 8.9912 9.0946 9.0946 9.3524 9.3524 9.7970 9.7970 k = 0.6111-0.0321 0.3856 ( 12597 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9429 -11.9429 -11.0490 -11.0490 -10.9599 -10.9599 -10.9253 -10.9253 -10.7722 -10.7722 -10.6866 -10.6866 -7.6792 -7.6792 -7.3883 -7.3883 -7.3741 -7.3741 -6.5188 -6.5188 -6.5170 -6.5170 -6.5107 -6.5107 -6.5035 -6.5035 -1.8635 -1.8635 -1.5899 -1.5899 -1.4627 -1.4627 0.2038 0.2038 0.3721 0.3721 0.5643 0.5643 0.7961 0.7961 0.9083 0.9083 1.1245 1.1245 1.2283 1.2283 1.2720 1.2720 1.3988 1.3988 1.5087 1.5087 1.6033 1.6033 1.7781 1.7781 1.8387 1.8387 2.1565 2.1565 2.7819 2.7819 5.2549 5.2549 5.8368 5.8368 6.0603 6.0603 9.0351 9.0351 9.1477 9.1477 9.3344 9.3344 9.8210 9.8210 k = 0.6181-0.0521 0.3969 ( 12608 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9420 -11.9420 -11.0438 -11.0438 -10.9622 -10.9622 -10.9286 -10.9286 -10.7775 -10.7775 -10.6831 -10.6831 -7.6776 -7.6776 -7.3883 -7.3883 -7.3737 -7.3737 -6.5186 -6.5186 -6.5165 -6.5165 -6.5108 -6.5108 -6.5030 -6.5030 -1.8552 -1.8552 -1.5894 -1.5894 -1.4678 -1.4678 0.1904 0.1904 0.3630 0.3630 0.5670 0.5670 0.8124 0.8124 0.9209 0.9209 1.1395 1.1395 1.2315 1.2315 1.2551 1.2551 1.4022 1.4022 1.4951 1.4951 1.5876 1.5876 1.7646 1.7646 1.8234 1.8234 2.1678 2.1678 2.7906 2.7906 5.2751 5.2751 5.8407 5.8407 6.0478 6.0478 9.0654 9.0654 9.1905 9.1905 9.3238 9.3238 9.8433 9.8433 k = 0.6250-0.0722 0.4082 ( 12600 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9415 -11.9415 -11.0394 -11.0394 -10.9630 -10.9630 -10.9318 -10.9318 -10.7830 -10.7830 -10.6796 -10.6796 -7.6765 -7.6765 -7.3883 -7.3883 -7.3733 -7.3733 -6.5187 -6.5187 -6.5162 -6.5162 -6.5109 -6.5109 -6.5025 -6.5025 -1.8492 -1.8492 -1.5885 -1.5885 -1.4715 -1.4715 0.1779 0.1779 0.3519 0.3519 0.5740 0.5740 0.8276 0.8276 0.9355 0.9355 1.1449 1.1449 1.2310 1.2310 1.2435 1.2435 1.4078 1.4078 1.4858 1.4858 1.5781 1.5781 1.7513 1.7513 1.8100 1.8100 2.1792 2.1792 2.7965 2.7965 5.2890 5.2890 5.8452 5.8452 6.0370 6.0370 9.0723 9.0723 9.2169 9.2169 9.3334 9.3334 9.8619 9.8619 k = 0.6250-0.0722 0.4082 ( 12600 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9415 -11.9415 -11.0394 -11.0394 -10.9630 -10.9630 -10.9318 -10.9318 -10.7830 -10.7830 -10.6796 -10.6796 -7.6765 -7.6765 -7.3883 -7.3883 -7.3733 -7.3733 -6.5187 -6.5187 -6.5162 -6.5162 -6.5109 -6.5109 -6.5025 -6.5025 -1.8492 -1.8492 -1.5885 -1.5885 -1.4715 -1.4715 0.1779 0.1779 0.3519 0.3519 0.5740 0.5740 0.8276 0.8276 0.9355 0.9355 1.1449 1.1449 1.2310 1.2310 1.2435 1.2435 1.4078 1.4078 1.4858 1.4858 1.5781 1.5781 1.7513 1.7513 1.8100 1.8100 2.1792 2.1792 2.7965 2.7965 5.2890 5.2890 5.8452 5.8452 6.0370 6.0370 9.0723 9.0723 9.2169 9.2169 9.3334 9.3334 9.8619 9.8619 k = 0.6136-0.0656 0.4268 ( 12609 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9415 -11.9415 -11.0392 -11.0392 -10.9630 -10.9630 -10.9324 -10.9324 -10.7823 -10.7823 -10.6799 -10.6799 -7.6764 -7.6764 -7.3883 -7.3883 -7.3733 -7.3733 -6.5187 -6.5187 -6.5161 -6.5161 -6.5109 -6.5109 -6.5025 -6.5025 -1.8487 -1.8487 -1.5886 -1.5886 -1.4721 -1.4721 0.1790 0.1790 0.3523 0.3523 0.5720 0.5720 0.8287 0.8287 0.9359 0.9359 1.1440 1.1440 1.2285 1.2285 1.2469 1.2469 1.4074 1.4074 1.4832 1.4832 1.5793 1.5793 1.7505 1.7505 1.8120 1.8120 2.1775 2.1775 2.7969 2.7969 5.2905 5.2905 5.8454 5.8454 6.0359 6.0359 9.0750 9.0750 9.2195 9.2195 9.3358 9.3358 9.8619 9.8619 k = 0.6023-0.0590 0.4454 ( 12602 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9414 -11.9414 -11.0386 -11.0386 -10.9631 -10.9631 -10.9341 -10.9341 -10.7805 -10.7805 -10.6808 -10.6808 -7.6763 -7.6763 -7.3882 -7.3882 -7.3732 -7.3732 -6.5185 -6.5185 -6.5161 -6.5161 -6.5109 -6.5109 -6.5026 -6.5026 -1.8472 -1.8472 -1.5886 -1.5886 -1.4739 -1.4739 0.1822 0.1822 0.3532 0.3532 0.5666 0.5666 0.8312 0.8312 0.9376 0.9376 1.1413 1.1413 1.2241 1.2241 1.2539 1.2539 1.4061 1.4061 1.4761 1.4761 1.5825 1.5825 1.7477 1.7477 1.8186 1.8186 2.1723 2.1723 2.7981 2.7981 5.2951 5.2951 5.8458 5.8458 6.0324 6.0324 9.0830 9.0830 9.2273 9.2273 9.3431 9.3431 9.8615 9.8615 k = 0.5909-0.0525 0.4639 ( 12592 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9411 -11.9411 -11.0377 -11.0377 -10.9632 -10.9632 -10.9368 -10.9368 -10.7777 -10.7777 -10.6822 -10.6822 -7.6761 -7.6761 -7.3881 -7.3881 -7.3732 -7.3732 -6.5183 -6.5183 -6.5160 -6.5160 -6.5109 -6.5109 -6.5028 -6.5028 -1.8449 -1.8449 -1.5887 -1.5887 -1.4766 -1.4766 0.1876 0.1876 0.3542 0.3542 0.5587 0.5587 0.8331 0.8331 0.9416 0.9416 1.1371 1.1371 1.2197 1.2197 1.2623 1.2623 1.4031 1.4031 1.4667 1.4667 1.5871 1.5871 1.7418 1.7418 1.8299 1.8299 2.1639 2.1639 2.8000 2.8000 5.3023 5.3023 5.8467 5.8467 6.0268 6.0268 9.0961 9.0961 9.2398 9.2398 9.3548 9.3548 9.8601 9.8601 k = 0.5795-0.0459 0.4825 ( 12578 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9409 -11.9409 -11.0364 -11.0364 -10.9634 -10.9634 -10.9403 -10.9403 -10.7740 -10.7740 -10.6841 -10.6841 -7.6758 -7.6758 -7.3880 -7.3880 -7.3731 -7.3731 -6.5180 -6.5180 -6.5158 -6.5158 -6.5108 -6.5108 -6.5030 -6.5030 -1.8418 -1.8418 -1.5887 -1.5887 -1.4803 -1.4803 0.1950 0.1950 0.3547 0.3547 0.5501 0.5501 0.8326 0.8326 0.9495 0.9495 1.1319 1.1319 1.2154 1.2154 1.2713 1.2713 1.3973 1.3973 1.4579 1.4579 1.5925 1.5925 1.7326 1.7326 1.8455 1.8455 2.1525 2.1525 2.8024 2.8024 5.3117 5.3117 5.8481 5.8481 6.0192 6.0192 9.1141 9.1141 9.2565 9.2565 9.3707 9.3707 9.8558 9.8558 k = 0.5682-0.0394 0.5010 ( 12580 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9405 -11.9405 -11.0349 -11.0349 -10.9637 -10.9637 -10.9441 -10.9441 -10.7697 -10.7697 -10.6865 -10.6865 -7.6754 -7.6754 -7.3878 -7.3878 -7.3730 -7.3730 -6.5177 -6.5177 -6.5157 -6.5157 -6.5107 -6.5107 -6.5032 -6.5032 -1.8383 -1.8383 -1.5885 -1.5885 -1.4847 -1.4847 0.2043 0.2043 0.3537 0.3537 0.5421 0.5421 0.8282 0.8282 0.9616 0.9616 1.1259 1.1259 1.2109 1.2109 1.2808 1.2808 1.3879 1.3879 1.4517 1.4517 1.5984 1.5984 1.7207 1.7207 1.8644 1.8644 2.1382 2.1382 2.8053 2.8053 5.3224 5.3224 5.8502 5.8502 6.0099 6.0099 9.1366 9.1366 9.2763 9.2763 9.3901 9.3901 9.8449 9.8449 k = 0.5568-0.0328 0.5196 ( 12580 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9402 -11.9402 -11.0332 -11.0332 -10.9641 -10.9641 -10.9480 -10.9480 -10.7651 -10.7651 -10.6892 -10.6892 -7.6750 -7.6750 -7.3877 -7.3877 -7.3729 -7.3729 -6.5173 -6.5173 -6.5155 -6.5155 -6.5106 -6.5106 -6.5035 -6.5035 -1.8345 -1.8345 -1.5881 -1.5881 -1.4895 -1.4895 0.2153 0.2153 0.3505 0.3505 0.5362 0.5362 0.8206 0.8206 0.9774 0.9774 1.1194 1.1194 1.2060 1.2060 1.2903 1.2903 1.3759 1.3759 1.4485 1.4485 1.6047 1.6047 1.7068 1.7068 1.8856 1.8856 2.1215 2.1215 2.8083 2.8083 5.3337 5.3337 5.8534 5.8534 5.9994 5.9994 9.1632 9.1632 9.2981 9.2981 9.4121 9.4121 9.8217 9.8217 k = 0.5455-0.0262 0.5381 ( 12585 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9398 -11.9398 -11.0315 -11.0315 -10.9647 -10.9647 -10.9516 -10.9516 -10.7604 -10.7604 -10.6922 -10.6922 -7.6746 -7.6746 -7.3875 -7.3875 -7.3728 -7.3728 -6.5169 -6.5169 -6.5153 -6.5153 -6.5105 -6.5105 -6.5038 -6.5038 -1.8308 -1.8308 -1.5874 -1.5874 -1.4945 -1.4945 0.2277 0.2277 0.3443 0.3443 0.5330 0.5330 0.8107 0.8107 0.9955 0.9955 1.1125 1.1125 1.2004 1.2004 1.2996 1.2996 1.3631 1.3631 1.4473 1.4473 1.6111 1.6111 1.6917 1.6917 1.9081 1.9081 2.1027 2.1027 2.8114 2.8114 5.3446 5.3446 5.8576 5.8576 5.9882 5.9882 9.1933 9.1933 9.3200 9.3200 9.4352 9.4352 9.7841 9.7841 k = 0.5341-0.0197 0.5567 ( 12581 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9395 -11.9395 -11.0299 -11.0299 -10.9655 -10.9655 -10.9545 -10.9545 -10.7561 -10.7561 -10.6951 -10.6951 -7.6743 -7.6743 -7.3874 -7.3874 -7.3727 -7.3727 -6.5165 -6.5165 -6.5152 -6.5152 -6.5104 -6.5104 -6.5041 -6.5041 -1.8275 -1.8275 -1.5865 -1.5865 -1.4991 -1.4991 0.2415 0.2415 0.3351 0.3351 0.5323 0.5323 0.8004 0.8004 1.0146 1.0146 1.1053 1.1053 1.1942 1.1942 1.3082 1.3082 1.3515 1.3515 1.4470 1.4470 1.6176 1.6176 1.6768 1.6768 1.9313 1.9313 2.0825 2.0825 2.8142 2.8142 5.3542 5.3542 5.8630 5.8630 5.9769 5.9769 9.2260 9.2260 9.3394 9.3394 9.4573 9.4573 9.7386 9.7386 k = 0.5227-0.0131 0.5753 ( 12576 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9392 -11.9392 -11.0286 -11.0286 -10.9665 -10.9665 -10.9565 -10.9565 -10.7524 -10.7524 -10.6977 -10.6977 -7.6740 -7.6740 -7.3873 -7.3873 -7.3726 -7.3726 -6.5162 -6.5162 -6.5151 -6.5151 -6.5103 -6.5103 -6.5044 -6.5044 -1.8250 -1.8250 -1.5853 -1.5853 -1.5031 -1.5031 0.2559 0.2559 0.3235 0.3235 0.5333 0.5333 0.7912 0.7912 1.0331 1.0331 1.0976 1.0976 1.1879 1.1879 1.3155 1.3155 1.3424 1.3424 1.4468 1.4468 1.6239 1.6239 1.6632 1.6632 1.9542 1.9542 2.0616 2.0616 2.8165 2.8165 5.3616 5.3616 5.8689 5.8689 5.9664 5.9664 9.2604 9.2604 9.3520 9.3520 9.4753 9.4753 9.6957 9.6957 k = 0.5114-0.0066 0.5938 ( 12586 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9390 -11.9390 -11.0278 -11.0278 -10.9674 -10.9674 -10.9576 -10.9576 -10.7499 -10.7499 -10.6995 -10.6995 -7.6737 -7.6737 -7.3872 -7.3872 -7.3726 -7.3726 -6.5160 -6.5160 -6.5150 -6.5150 -6.5102 -6.5102 -6.5045 -6.5045 -1.8233 -1.8233 -1.5844 -1.5844 -1.5059 -1.5059 0.2697 0.2697 0.3113 0.3113 0.5347 0.5347 0.7848 0.7848 1.0487 1.0487 1.0899 1.0899 1.1827 1.1827 1.3208 1.3208 1.3367 1.3367 1.4465 1.4465 1.6291 1.6291 1.6529 1.6529 1.9750 1.9750 2.0419 2.0419 2.8181 2.8181 5.3663 5.3663 5.8741 5.8741 5.9585 5.9585 9.2953 9.2953 9.3513 9.3513 9.4856 9.4856 9.6662 9.6662 k = 0.5000 0.0000 0.6124 ( 12568 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9389 -11.9389 -11.0275 -11.0275 -10.9677 -10.9677 -10.9580 -10.9580 -10.7490 -10.7490 -10.7002 -10.7002 -7.6737 -7.6737 -7.3872 -7.3872 -7.3726 -7.3726 -6.5159 -6.5159 -6.5150 -6.5150 -6.5102 -6.5102 -6.5046 -6.5046 -1.8228 -1.8228 -1.5839 -1.5839 -1.5069 -1.5069 0.2774 0.2774 0.3040 0.3040 0.5353 0.5353 0.7825 0.7825 1.0559 1.0559 1.0858 1.0858 1.1805 1.1805 1.3228 1.3228 1.3348 1.3348 1.4462 1.4462 1.6313 1.6313 1.6489 1.6489 1.9858 1.9858 2.0315 2.0315 2.8186 2.8186 5.3678 5.3678 5.8764 5.8764 5.9554 5.9554 9.3266 9.3266 9.3326 9.3326 9.4880 9.4880 9.6567 9.6567 k = 0.5000 0.0000 0.6124 ( 12568 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9389 -11.9389 -11.0275 -11.0275 -10.9677 -10.9677 -10.9580 -10.9580 -10.7490 -10.7490 -10.7002 -10.7002 -7.6737 -7.6737 -7.3872 -7.3872 -7.3726 -7.3726 -6.5159 -6.5159 -6.5150 -6.5150 -6.5102 -6.5102 -6.5046 -6.5046 -1.8228 -1.8228 -1.5839 -1.5839 -1.5069 -1.5069 0.2774 0.2774 0.3040 0.3040 0.5353 0.5353 0.7825 0.7825 1.0559 1.0559 1.0858 1.0858 1.1805 1.1805 1.3228 1.3228 1.3348 1.3348 1.4462 1.4462 1.6313 1.6313 1.6489 1.6489 1.9858 1.9858 2.0315 2.0315 2.8186 2.8186 5.3678 5.3678 5.8764 5.8764 5.9554 5.9554 9.3266 9.3266 9.3326 9.3326 9.4880 9.4880 9.6567 9.6567 k = 0.5000 0.0137 0.5929 ( 12582 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9391 -11.9391 -11.0286 -11.0286 -10.9670 -10.9670 -10.9572 -10.9572 -10.7489 -10.7489 -10.7003 -10.7003 -7.6739 -7.6739 -7.3872 -7.3872 -7.3726 -7.3726 -6.5160 -6.5160 -6.5151 -6.5151 -6.5102 -6.5102 -6.5046 -6.5046 -1.8241 -1.8241 -1.5847 -1.5847 -1.5051 -1.5051 0.2776 0.2776 0.3048 0.3048 0.5362 0.5362 0.7820 0.7820 1.0424 1.0424 1.0922 1.0922 1.1852 1.1852 1.3213 1.3213 1.3387 1.3387 1.4445 1.4445 1.6332 1.6332 1.6516 1.6516 1.9860 1.9860 2.0317 2.0317 2.8173 2.8173 5.3645 5.3645 5.8717 5.8717 5.9617 5.9617 9.3105 9.3105 9.3210 9.3210 9.5010 9.5010 9.6551 9.6551 k = 0.5000 0.0275 0.5735 ( 12572 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9395 -11.9395 -11.0316 -11.0316 -10.9651 -10.9651 -10.9550 -10.9550 -10.7486 -10.7486 -10.7006 -10.7006 -7.6746 -7.6746 -7.3873 -7.3873 -7.3728 -7.3728 -6.5162 -6.5162 -6.5153 -6.5153 -6.5102 -6.5102 -6.5047 -6.5047 -1.8281 -1.8281 -1.5867 -1.5867 -1.5002 -1.5002 0.2783 0.2783 0.3069 0.3069 0.5392 0.5392 0.7805 0.7805 1.0180 1.0180 1.0964 1.0964 1.1984 1.1984 1.3171 1.3171 1.3499 1.3499 1.4401 1.4401 1.6386 1.6386 1.6595 1.6595 1.9867 1.9867 2.0325 2.0325 2.8134 2.8134 5.3546 5.3546 5.8613 5.8613 5.9769 5.9769 9.2675 9.2675 9.2941 9.2941 9.5282 9.5282 9.6495 9.6495 k = 0.5000 0.0412 0.5541 ( 12576 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9402 -11.9402 -11.0361 -11.0361 -10.9623 -10.9623 -10.9514 -10.9514 -10.7481 -10.7481 -10.7012 -10.7012 -7.6757 -7.6757 -7.3875 -7.3875 -7.3731 -7.3731 -6.5166 -6.5166 -6.5156 -6.5156 -6.5102 -6.5102 -6.5048 -6.5048 -1.8347 -1.8347 -1.5890 -1.5890 -1.4931 -1.4931 0.2795 0.2795 0.3102 0.3102 0.5440 0.5440 0.7780 0.7780 0.9918 0.9918 1.0930 1.0930 1.2162 1.2162 1.3110 1.3110 1.3665 1.3665 1.4352 1.4352 1.6472 1.6472 1.6717 1.6717 1.9879 1.9879 2.0338 2.0338 2.8069 2.8069 5.3379 5.3379 5.8503 5.8503 5.9962 5.9962 9.2124 9.2124 9.2543 9.2543 9.5565 9.5565 9.6387 9.6387 k = 0.5000 0.0550 0.5346 ( 12578 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9411 -11.9411 -11.0416 -11.0416 -10.9591 -10.9591 -10.9467 -10.9467 -10.7475 -10.7475 -10.7020 -10.7020 -7.6772 -7.6772 -7.3877 -7.3877 -7.3736 -7.3736 -6.5171 -6.5171 -6.5160 -6.5160 -6.5102 -6.5102 -6.5050 -6.5050 -1.8438 -1.8438 -1.5907 -1.5907 -1.4845 -1.4845 0.2813 0.2813 0.3144 0.3144 0.5504 0.5504 0.7743 0.7743 0.9665 0.9665 1.0845 1.0845 1.2322 1.2322 1.3044 1.3044 1.3856 1.3856 1.4340 1.4340 1.6585 1.6585 1.6874 1.6874 1.9894 1.9894 2.0356 2.0356 2.7980 2.7980 5.3145 5.3145 5.8414 5.8414 6.0169 6.0169 9.1514 9.1514 9.2054 9.2054 9.5803 9.5803 9.6225 9.6225 k = 0.5000 0.0687 0.5152 ( 12574 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9423 -11.9423 -11.0477 -11.0477 -10.9554 -10.9554 -10.9413 -10.9413 -10.7466 -10.7466 -10.7030 -10.7030 -7.6791 -7.6791 -7.3879 -7.3879 -7.3741 -7.3741 -6.5177 -6.5177 -6.5166 -6.5166 -6.5102 -6.5102 -6.5051 -6.5051 -1.8552 -1.8552 -1.5913 -1.5913 -1.4753 -1.4753 0.2838 0.2838 0.3193 0.3193 0.5581 0.5581 0.7694 0.7694 0.9435 0.9435 1.0734 1.0734 1.2403 1.2403 1.2988 1.2988 1.4023 1.4023 1.4437 1.4437 1.6723 1.6723 1.7057 1.7057 1.9913 1.9913 2.0377 2.0377 2.7869 2.7869 5.2847 5.2847 5.8357 5.8357 6.0377 6.0377 9.0872 9.0872 9.1507 9.1507 9.5938 9.5938 9.6054 9.6054 k = 0.5000 0.0825 0.4957 ( 12586 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9437 -11.9437 -11.0540 -11.0540 -10.9512 -10.9512 -10.9355 -10.9355 -10.7457 -10.7457 -10.7042 -10.7042 -7.6813 -7.6813 -7.3882 -7.3882 -7.3748 -7.3748 -6.5184 -6.5184 -6.5173 -6.5173 -6.5102 -6.5102 -6.5053 -6.5053 -1.8686 -1.8686 -1.5906 -1.5906 -1.4657 -1.4657 0.2870 0.2870 0.3246 0.3246 0.5669 0.5669 0.7632 0.7632 0.9236 0.9236 1.0609 1.0609 1.2373 1.2373 1.2937 1.2937 1.4168 1.4168 1.4665 1.4665 1.6882 1.6882 1.7258 1.7258 1.9935 1.9935 2.0402 2.0402 2.7737 2.7737 5.2490 5.2490 5.8335 5.8335 6.0580 6.0580 9.0216 9.0216 9.0927 9.0927 9.5741 9.5741 9.6107 9.6107 k = 0.5000 0.0962 0.4763 ( 12580 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9452 -11.9452 -11.0604 -11.0604 -10.9466 -10.9466 -10.9296 -10.9296 -10.7445 -10.7445 -10.7056 -10.7056 -7.6838 -7.6838 -7.3886 -7.3886 -7.3755 -7.3755 -6.5193 -6.5193 -6.5181 -6.5181 -6.5102 -6.5102 -6.5054 -6.5054 -1.8835 -1.8835 -1.5884 -1.5884 -1.4562 -1.4562 0.2908 0.2908 0.3301 0.3301 0.5763 0.5763 0.7560 0.7560 0.9073 0.9073 1.0480 1.0480 1.2262 1.2262 1.2855 1.2855 1.4351 1.4351 1.4960 1.4960 1.7061 1.7061 1.7474 1.7474 1.9960 1.9960 2.0430 2.0430 2.7588 2.7588 5.2082 5.2082 5.8347 5.8347 6.0775 6.0775 8.9557 8.9557 9.0332 9.0332 9.5471 9.5471 9.6142 9.6142 k = 0.5000 0.1100 0.4568 ( 12590 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9469 -11.9469 -11.0667 -11.0667 -10.9416 -10.9416 -10.9237 -10.9237 -10.7433 -10.7433 -10.7072 -10.7072 -7.6865 -7.6865 -7.3889 -7.3889 -7.3763 -7.3763 -6.5202 -6.5202 -6.5189 -6.5189 -6.5103 -6.5103 -6.5056 -6.5056 -1.8997 -1.8997 -1.5851 -1.5851 -1.4468 -1.4468 0.2949 0.2949 0.3357 0.3357 0.5858 0.5858 0.7484 0.7484 0.8946 0.8946 1.0351 1.0351 1.2104 1.2104 1.2730 1.2730 1.4586 1.4586 1.5278 1.5278 1.7257 1.7257 1.7699 1.7699 1.9987 1.9987 2.0460 2.0460 2.7425 2.7425 5.1632 5.1632 5.8386 5.8386 6.0959 6.0959 8.8904 8.8904 8.9737 8.9737 9.5186 9.5186 9.6111 9.6111 k = 0.5000 0.1237 0.4374 ( 12598 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9487 -11.9487 -11.0729 -11.0729 -10.9362 -10.9362 -10.9180 -10.9180 -10.7419 -10.7419 -10.7090 -10.7090 -7.6894 -7.6894 -7.3893 -7.3893 -7.3771 -7.3771 -6.5211 -6.5211 -6.5198 -6.5198 -6.5103 -6.5103 -6.5057 -6.5057 -1.9165 -1.9165 -1.5807 -1.5807 -1.4377 -1.4377 0.2992 0.2992 0.3410 0.3410 0.5949 0.5949 0.7415 0.7415 0.8851 0.8851 1.0229 1.0229 1.1921 1.1921 1.2571 1.2571 1.4856 1.4856 1.5599 1.5599 1.7469 1.7469 1.7932 1.7932 2.0017 2.0017 2.0492 2.0492 2.7250 2.7250 5.1150 5.1150 5.8447 5.8447 6.1133 6.1133 8.8266 8.8266 8.9152 8.9152 9.4898 9.4898 9.6013 9.6013 k = 0.5000 0.1375 0.4180 ( 12596 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9505 -11.9505 -11.0788 -11.0788 -10.9307 -10.9307 -10.9126 -10.9126 -10.7405 -10.7405 -10.7109 -10.7109 -7.6924 -7.6924 -7.3897 -7.3897 -7.3780 -7.3780 -6.5221 -6.5221 -6.5208 -6.5208 -6.5104 -6.5104 -6.5059 -6.5059 -1.9335 -1.9335 -1.5755 -1.5755 -1.4289 -1.4289 0.3034 0.3034 0.3461 0.3461 0.6031 0.6031 0.7361 0.7361 0.8784 0.8784 1.0117 1.0117 1.1721 1.1721 1.2392 1.2392 1.5142 1.5142 1.5909 1.5909 1.7694 1.7694 1.8169 1.8169 2.0050 2.0050 2.0524 2.0524 2.7066 2.7066 5.0648 5.0648 5.8524 5.8524 6.1295 6.1295 8.7650 8.7650 8.8587 8.8587 9.4615 9.4615 9.5844 9.5844 k = 0.5000 0.1512 0.3985 ( 12594 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9524 -11.9524 -11.0843 -11.0843 -10.9250 -10.9250 -10.9074 -10.9074 -10.7391 -10.7391 -10.7130 -10.7130 -7.6955 -7.6955 -7.3901 -7.3901 -7.3788 -7.3788 -6.5231 -6.5231 -6.5218 -6.5218 -6.5104 -6.5104 -6.5060 -6.5060 -1.9505 -1.9505 -1.5698 -1.5698 -1.4205 -1.4205 0.3074 0.3074 0.3506 0.3506 0.6102 0.6102 0.7331 0.7331 0.8738 0.8738 1.0018 1.0018 1.1510 1.1510 1.2201 1.2201 1.5434 1.5434 1.6200 1.6200 1.7930 1.7930 1.8408 1.8408 2.0086 2.0086 2.0559 2.0559 2.6878 2.6878 5.0137 5.0137 5.8610 5.8610 6.1447 6.1447 8.7064 8.7064 8.8050 8.8050 9.4343 9.4343 9.5600 9.5600 k = 0.5000 0.1650 0.3791 ( 12620 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9542 -11.9542 -11.0895 -11.0895 -10.9193 -10.9193 -10.9026 -10.9026 -10.7376 -10.7376 -10.7152 -10.7152 -7.6985 -7.6985 -7.3906 -7.3906 -7.3797 -7.3797 -6.5241 -6.5241 -6.5228 -6.5228 -6.5105 -6.5105 -6.5061 -6.5061 -1.9668 -1.9668 -1.5640 -1.5640 -1.4126 -1.4126 0.3110 0.3110 0.3545 0.3545 0.6162 0.6162 0.7326 0.7326 0.8708 0.8708 0.9939 0.9939 1.1292 1.1292 1.2003 1.2003 1.5721 1.5721 1.6466 1.6466 1.8169 1.8169 1.8646 1.8646 2.0126 2.0126 2.0595 2.0595 2.6688 2.6688 4.9627 4.9627 5.8700 5.8700 6.1587 6.1587 8.6513 8.6513 8.7546 8.7546 9.4087 9.4087 9.5285 9.5285 k = 0.5000 0.1787 0.3596 ( 12608 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9559 -11.9559 -11.0942 -11.0942 -10.9137 -10.9137 -10.8982 -10.8982 -10.7362 -10.7362 -10.7175 -10.7175 -7.7014 -7.7014 -7.3909 -7.3909 -7.3805 -7.3805 -6.5251 -6.5251 -6.5238 -6.5238 -6.5105 -6.5105 -6.5062 -6.5062 -1.9823 -1.9823 -1.5581 -1.5581 -1.4052 -1.4052 0.3139 0.3139 0.3576 0.3576 0.6215 0.6215 0.7343 0.7343 0.8693 0.8693 0.9881 0.9881 1.1070 1.1070 1.1802 1.1802 1.5998 1.5998 1.6701 1.6701 1.8405 1.8405 1.8878 1.8878 2.0170 2.0170 2.0635 2.0635 2.6501 2.6501 4.9129 4.9129 5.8790 5.8790 6.1716 6.1716 8.6004 8.6004 8.7080 8.7080 9.3850 9.3850 9.4920 9.4920 k = 0.5000 0.1925 0.3402 ( 12606 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9575 -11.9575 -11.0985 -11.0985 -10.9085 -10.9085 -10.8942 -10.8942 -10.7348 -10.7348 -10.7197 -10.7197 -7.7041 -7.7041 -7.3913 -7.3913 -7.3813 -7.3813 -6.5260 -6.5260 -6.5247 -6.5247 -6.5105 -6.5105 -6.5062 -6.5062 -1.9967 -1.9967 -1.5525 -1.5525 -1.3983 -1.3983 0.3161 0.3161 0.3601 0.3601 0.6268 0.6268 0.7371 0.7371 0.8692 0.8692 0.9850 0.9850 1.0847 1.0847 1.1602 1.1602 1.6257 1.6257 1.6905 1.6905 1.8626 1.8626 1.9102 1.9102 2.0218 2.0218 2.0682 2.0682 2.6320 2.6320 4.8655 4.8655 5.8875 5.8875 6.1833 6.1833 8.5541 8.5541 8.6659 8.6659 9.3635 9.3635 9.4533 9.4533 k = 0.5000 0.2062 0.3208 ( 12600 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9590 -11.9590 -11.1022 -11.1022 -10.9036 -10.9036 -10.8905 -10.8905 -10.7336 -10.7336 -10.7219 -10.7219 -7.7067 -7.7067 -7.3916 -7.3916 -7.3820 -7.3820 -6.5268 -6.5268 -6.5256 -6.5256 -6.5106 -6.5106 -6.5063 -6.5063 -2.0096 -2.0096 -1.5474 -1.5474 -1.3920 -1.3920 0.3175 0.3175 0.3619 0.3619 0.6327 0.6327 0.7396 0.7396 0.8709 0.8709 0.9845 0.9845 1.0623 1.0623 1.1405 1.1405 1.6495 1.6495 1.7077 1.7077 1.8822 1.8822 1.9312 1.9312 2.0265 2.0265 2.0738 2.0738 2.6150 2.6150 4.8216 4.8216 5.8953 5.8953 6.1937 6.1937 8.5129 8.5129 8.6285 8.6285 9.3444 9.3444 9.4152 9.4152 k = 0.5000 0.2199 0.3013 ( 12606 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9603 -11.9603 -11.1055 -11.1055 -10.8994 -10.8994 -10.8872 -10.8872 -10.7324 -10.7324 -10.7240 -10.7240 -7.7089 -7.7089 -7.3919 -7.3919 -7.3826 -7.3826 -6.5276 -6.5276 -6.5264 -6.5264 -6.5106 -6.5106 -6.5063 -6.5063 -2.0209 -2.0209 -1.5428 -1.5428 -1.3865 -1.3865 0.3182 0.3182 0.3633 0.3633 0.6393 0.6393 0.7408 0.7408 0.8751 0.8751 0.9867 0.9867 1.0403 1.0403 1.1213 1.1213 1.6708 1.6708 1.7218 1.7218 1.8984 1.8984 1.9506 1.9506 2.0306 2.0306 2.0808 2.0808 2.5995 2.5995 4.7821 4.7821 5.9022 5.9022 6.2028 6.2028 8.4774 8.4774 8.5963 8.5963 9.3279 9.3279 9.3800 9.3800 k = 0.5000 0.2337 0.2819 ( 12604 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9614 -11.9614 -11.1081 -11.1081 -10.8958 -10.8958 -10.8843 -10.8843 -10.7315 -10.7315 -10.7259 -10.7259 -7.7108 -7.7108 -7.3922 -7.3922 -7.3832 -7.3832 -6.5282 -6.5282 -6.5270 -6.5270 -6.5106 -6.5106 -6.5064 -6.5064 -2.0304 -2.0304 -1.5389 -1.5389 -1.3818 -1.3818 0.3183 0.3183 0.3642 0.3642 0.6468 0.6468 0.7400 0.7400 0.8821 0.8821 0.9909 0.9909 1.0190 1.0190 1.1029 1.1029 1.6892 1.6892 1.7326 1.7326 1.9108 1.9108 1.9683 1.9683 2.0332 2.0332 2.0889 2.0889 2.5860 2.5860 4.7481 4.7481 5.9079 5.9079 6.2104 6.2104 8.4478 8.4478 8.5696 8.5696 9.3142 9.3142 9.3495 9.3495 k = 0.5000 0.2474 0.2624 ( 12602 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9623 -11.9623 -11.1102 -11.1102 -10.8930 -10.8930 -10.8819 -10.8819 -10.7307 -10.7307 -10.7274 -10.7274 -7.7123 -7.7123 -7.3924 -7.3924 -7.3836 -7.3836 -6.5287 -6.5287 -6.5276 -6.5276 -6.5107 -6.5107 -6.5064 -6.5064 -2.0379 -2.0379 -1.5358 -1.5358 -1.3780 -1.3780 0.3180 0.3180 0.3649 0.3649 0.6546 0.6546 0.7373 0.7373 0.8921 0.8921 0.9919 0.9919 1.0036 1.0036 1.0854 1.0854 1.7045 1.7045 1.7403 1.7403 1.9197 1.9197 1.9839 1.9839 2.0342 2.0342 2.0971 2.0971 2.5749 2.5749 4.7206 4.7206 5.9125 5.9125 6.2165 6.2165 8.4244 8.4244 8.5485 8.5485 9.3031 9.3031 9.3249 9.3249 k = 0.5000 0.2612 0.2430 ( 12604 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9629 -11.9629 -11.1117 -11.1117 -10.8911 -10.8911 -10.8801 -10.8801 -10.7301 -10.7301 -10.7286 -10.7286 -7.7135 -7.7135 -7.3925 -7.3925 -7.3839 -7.3839 -6.5290 -6.5290 -6.5279 -6.5279 -6.5107 -6.5107 -6.5064 -6.5064 -2.0434 -2.0434 -1.5336 -1.5336 -1.3753 -1.3753 0.3176 0.3176 0.3654 0.3654 0.6619 0.6619 0.7334 0.7334 0.9048 0.9048 0.9748 0.9748 1.0088 1.0088 1.0695 1.0695 1.7162 1.7162 1.7452 1.7452 1.9254 1.9254 1.9969 1.9969 2.0333 2.0333 2.1041 2.1041 2.5666 2.5666 4.7003 4.7003 5.9158 5.9158 6.2210 6.2210 8.4075 8.4075 8.5333 8.5333 9.2945 9.2945 9.3075 9.3075 k = 0.5000 0.2749 0.2236 ( 12614 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9633 -11.9633 -11.1126 -11.1126 -10.8899 -10.8899 -10.8790 -10.8790 -10.7298 -10.7298 -10.7293 -10.7293 -7.7141 -7.7141 -7.3926 -7.3926 -7.3841 -7.3841 -6.5292 -6.5292 -6.5282 -6.5282 -6.5107 -6.5107 -6.5064 -6.5064 -2.0467 -2.0467 -1.5322 -1.5322 -1.3736 -1.3736 0.3173 0.3173 0.3657 0.3657 0.6673 0.6673 0.7298 0.7298 0.9197 0.9197 0.9558 0.9558 1.0174 1.0174 1.0561 1.0561 1.7238 1.7238 1.7476 1.7476 1.9285 1.9285 2.0064 2.0064 2.0313 2.0313 2.1089 2.1089 2.5615 2.5615 4.6879 4.6879 5.9177 5.9177 6.2237 6.2237 8.3973 8.3973 8.5241 8.5241 9.2882 9.2882 9.2979 9.2979 k = 0.5000 0.2887 0.2041 ( 12662 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9635 -11.9635 -11.1129 -11.1129 -10.8895 -10.8895 -10.8786 -10.8786 -10.7298 -10.7298 -10.7294 -10.7294 -7.7144 -7.7144 -7.3926 -7.3926 -7.3842 -7.3842 -6.5293 -6.5293 -6.5283 -6.5283 -6.5107 -6.5107 -6.5065 -6.5065 -2.0478 -2.0478 -1.5318 -1.5318 -1.3730 -1.3730 0.3172 0.3172 0.3658 0.3658 0.6694 0.6694 0.7283 0.7283 0.9333 0.9333 0.9407 0.9407 1.0223 1.0223 1.0496 1.0496 1.7265 1.7265 1.7482 1.7482 1.9296 1.9296 2.0102 2.0102 2.0300 2.0300 2.1105 2.1105 2.5597 2.5597 4.6837 4.6837 5.9184 5.9184 6.2246 6.2246 8.3939 8.3939 8.5210 8.5210 9.2856 9.2856 9.2951 9.2951 k = 0.5000 0.2887 0.2041 ( 12662 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9635 -11.9635 -11.1129 -11.1129 -10.8895 -10.8895 -10.8786 -10.8786 -10.7298 -10.7298 -10.7294 -10.7294 -7.7144 -7.7144 -7.3926 -7.3926 -7.3842 -7.3842 -6.5293 -6.5293 -6.5283 -6.5283 -6.5107 -6.5107 -6.5065 -6.5065 -2.0478 -2.0478 -1.5318 -1.5318 -1.3730 -1.3730 0.3172 0.3172 0.3658 0.3658 0.6694 0.6694 0.7283 0.7283 0.9333 0.9333 0.9407 0.9407 1.0223 1.0223 1.0496 1.0496 1.7265 1.7265 1.7482 1.7482 1.9296 1.9296 2.0102 2.0102 2.0300 2.0300 2.1105 2.1105 2.5597 2.5597 4.6837 4.6837 5.9184 5.9184 6.2246 6.2246 8.3939 8.3939 8.5210 8.5210 9.2856 9.2856 9.2951 9.2951 k = 0.4931 0.2847 0.2268 ( 12611 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9633 -11.9633 -11.1126 -11.1126 -10.8899 -10.8899 -10.8790 -10.8790 -10.7298 -10.7298 -10.7293 -10.7293 -7.7141 -7.7141 -7.3926 -7.3926 -7.3841 -7.3841 -6.5292 -6.5292 -6.5282 -6.5282 -6.5107 -6.5107 -6.5064 -6.5064 -2.0467 -2.0467 -1.5322 -1.5322 -1.3736 -1.3736 0.3173 0.3173 0.3657 0.3657 0.6673 0.6673 0.7298 0.7298 0.9195 0.9195 0.9560 0.9560 1.0173 1.0173 1.0562 1.0562 1.7238 1.7238 1.7476 1.7476 1.9285 1.9285 2.0063 2.0063 2.0313 2.0313 2.1088 2.1088 2.5615 2.5615 4.6879 4.6879 5.9177 5.9177 6.2236 6.2236 8.3974 8.3974 8.5242 8.5242 9.2882 9.2882 9.2980 9.2980 k = 0.4861 0.2807 0.2495 ( 12606 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9629 -11.9629 -11.1117 -11.1117 -10.8911 -10.8911 -10.8802 -10.8802 -10.7301 -10.7301 -10.7286 -10.7286 -7.7134 -7.7134 -7.3925 -7.3925 -7.3839 -7.3839 -6.5290 -6.5290 -6.5279 -6.5279 -6.5107 -6.5107 -6.5064 -6.5064 -2.0433 -2.0433 -1.5336 -1.5336 -1.3753 -1.3753 0.3176 0.3176 0.3654 0.3654 0.6617 0.6617 0.7335 0.7335 0.9045 0.9045 0.9753 0.9753 1.0086 1.0086 1.0698 1.0698 1.7160 1.7160 1.7451 1.7451 1.9253 1.9253 1.9967 1.9967 2.0333 2.0333 2.1040 2.1040 2.5667 2.5667 4.7006 4.7006 5.9157 5.9157 6.2209 6.2209 8.4078 8.4078 8.5335 8.5335 9.2945 9.2945 9.3078 9.3078 k = 0.4792 0.2766 0.2722 ( 12602 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9623 -11.9623 -11.1102 -11.1102 -10.8931 -10.8931 -10.8820 -10.8820 -10.7308 -10.7308 -10.7273 -10.7273 -7.7123 -7.7123 -7.3924 -7.3924 -7.3836 -7.3836 -6.5287 -6.5287 -6.5275 -6.5275 -6.5107 -6.5107 -6.5064 -6.5064 -2.0377 -2.0377 -1.5359 -1.5359 -1.3781 -1.3781 0.3180 0.3180 0.3649 0.3649 0.6543 0.6543 0.7373 0.7373 0.8917 0.8917 0.9925 0.9925 1.0035 1.0035 1.0860 1.0860 1.7040 1.7040 1.7402 1.7402 1.9194 1.9194 1.9836 1.9836 2.0339 2.0339 2.0970 2.0970 2.5752 2.5752 4.7213 4.7213 5.9124 5.9124 6.2164 6.2164 8.4250 8.4250 8.5490 8.5490 9.3030 9.3030 9.3260 9.3260 k = 0.4722 0.2726 0.2948 ( 12606 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9614 -11.9614 -11.1080 -11.1080 -10.8960 -10.8960 -10.8844 -10.8844 -10.7317 -10.7317 -10.7256 -10.7256 -7.7107 -7.7107 -7.3922 -7.3922 -7.3832 -7.3832 -6.5281 -6.5281 -6.5270 -6.5270 -6.5106 -6.5106 -6.5064 -6.5064 -2.0301 -2.0301 -1.5391 -1.5391 -1.3820 -1.3820 0.3181 0.3181 0.3644 0.3644 0.6465 0.6465 0.7400 0.7400 0.8817 0.8817 0.9913 0.9913 1.0194 1.0194 1.1036 1.1036 1.6884 1.6884 1.7324 1.7324 1.9101 1.9101 1.9683 1.9683 2.0318 2.0318 2.0894 2.0894 2.5865 2.5865 4.7494 4.7494 5.9077 5.9077 6.2102 6.2102 8.4489 8.4489 8.5705 8.5705 9.3132 9.3132 9.3522 9.3522 k = 0.4653 0.2686 0.3175 ( 12607 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9602 -11.9602 -11.1053 -11.1053 -10.8997 -10.8997 -10.8872 -10.8872 -10.7329 -10.7329 -10.7235 -10.7235 -7.7088 -7.7088 -7.3919 -7.3919 -7.3826 -7.3826 -6.5275 -6.5275 -6.5263 -6.5263 -6.5106 -6.5106 -6.5063 -6.5063 -2.0204 -2.0204 -1.5430 -1.5430 -1.3868 -1.3868 0.3174 0.3174 0.3640 0.3640 0.6391 0.6391 0.7404 0.7404 0.8748 0.8748 0.9875 0.9875 1.0407 1.0407 1.1223 1.1223 1.6694 1.6694 1.7218 1.7218 1.8967 1.8967 1.9519 1.9519 2.0258 2.0258 2.0835 2.0835 2.6002 2.6002 4.7839 4.7839 5.9018 5.9018 6.2024 6.2024 8.4790 8.4790 8.5978 8.5978 9.3252 9.3252 9.3857 9.3857 k = 0.4583 0.2646 0.3402 ( 12599 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9589 -11.9589 -11.1020 -11.1020 -10.9043 -10.9043 -10.8902 -10.8902 -10.7345 -10.7345 -10.7210 -10.7210 -7.7065 -7.7065 -7.3916 -7.3916 -7.3820 -7.3820 -6.5268 -6.5268 -6.5256 -6.5256 -6.5106 -6.5106 -6.5063 -6.5063 -2.0089 -2.0089 -1.5477 -1.5477 -1.3923 -1.3923 0.3153 0.3153 0.3641 0.3641 0.6324 0.6324 0.7385 0.7385 0.8707 0.8707 0.9864 0.9864 1.0625 1.0625 1.1418 1.1418 1.6473 1.6473 1.7084 1.7084 1.8785 1.8785 1.9351 1.9351 2.0154 2.0154 2.0809 2.0809 2.6160 2.6160 4.8240 4.8240 5.8949 5.8949 6.1932 6.1932 8.5152 8.5152 8.6307 8.6307 9.3381 9.3381 9.4262 9.4262 k = 0.4514 0.2606 0.3629 ( 12591 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9574 -11.9574 -11.0982 -11.0982 -10.9095 -10.9095 -10.8935 -10.8935 -10.7365 -10.7365 -10.7182 -10.7182 -7.7039 -7.7039 -7.3913 -7.3913 -7.3812 -7.3812 -6.5259 -6.5259 -6.5247 -6.5247 -6.5105 -6.5105 -6.5062 -6.5062 -1.9958 -1.9958 -1.5529 -1.5529 -1.3986 -1.3986 0.3113 0.3113 0.3651 0.3651 0.6266 0.6266 0.7349 0.7349 0.8688 0.8688 0.9885 0.9885 1.0843 1.0843 1.1618 1.1618 1.6224 1.6224 1.6926 1.6926 1.8558 1.8558 1.9184 1.9184 2.0013 2.0013 2.0819 2.0819 2.6331 2.6331 4.8684 4.8684 5.8869 5.8869 6.1828 6.1828 8.5569 8.5569 8.6687 8.6687 9.3513 9.3513 9.4731 9.4731 k = 0.4444 0.2566 0.3856 ( 12592 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9558 -11.9558 -11.0939 -11.0939 -10.9153 -10.9153 -10.8969 -10.8969 -10.7389 -10.7389 -10.7151 -10.7151 -7.7012 -7.7012 -7.3909 -7.3909 -7.3804 -7.3804 -6.5250 -6.5250 -6.5237 -6.5237 -6.5105 -6.5105 -6.5061 -6.5061 -1.9813 -1.9813 -1.5586 -1.5586 -1.4054 -1.4054 0.3049 0.3049 0.3670 0.3670 0.6211 0.6211 0.7310 0.7310 0.8685 0.8685 0.9942 0.9942 1.1058 1.1058 1.1822 1.1822 1.5951 1.5951 1.6745 1.6745 1.8294 1.8294 1.9016 1.9016 1.9849 1.9849 2.0855 2.0855 2.6513 2.6513 4.9161 4.9161 5.8783 5.8783 6.1712 6.1712 8.6037 8.6037 8.7115 8.7115 9.3639 9.3639 9.5261 9.5261 k = 0.4375 0.2526 0.4082 ( 12612 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9540 -11.9540 -11.0891 -11.0891 -10.9216 -10.9216 -10.9004 -10.9004 -10.7418 -10.7418 -10.7118 -10.7118 -7.6982 -7.6982 -7.3905 -7.3905 -7.3796 -7.3796 -6.5241 -6.5241 -6.5228 -6.5228 -6.5105 -6.5105 -6.5060 -6.5060 -1.9658 -1.9658 -1.5645 -1.5645 -1.4126 -1.4126 0.2962 0.2962 0.3699 0.3699 0.6153 0.6153 0.7283 0.7283 0.8693 0.8693 1.0033 1.0033 1.1267 1.1267 1.2027 1.2027 1.5657 1.5657 1.6546 1.6546 1.8005 1.8005 1.8847 1.8847 1.9672 1.9672 2.0910 2.0910 2.6701 2.6701 4.9656 4.9656 5.8692 5.8692 6.1587 6.1587 8.6547 8.6547 8.7586 8.7586 9.3747 9.3747 9.5843 9.5843 k = 0.4306 0.2486 0.4309 ( 12608 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9522 -11.9522 -11.0839 -11.0839 -10.9280 -10.9280 -10.9039 -10.9039 -10.7450 -10.7450 -10.7084 -10.7084 -7.6952 -7.6952 -7.3901 -7.3901 -7.3787 -7.3787 -6.5231 -6.5231 -6.5218 -6.5218 -6.5105 -6.5105 -6.5058 -6.5058 -1.9495 -1.9495 -1.5704 -1.5704 -1.4200 -1.4200 0.2855 0.2855 0.3733 0.3733 0.6083 0.6083 0.7284 0.7284 0.8709 0.8709 1.0155 1.0155 1.1467 1.1467 1.2229 1.2229 1.5348 1.5348 1.6332 1.6332 1.7701 1.7701 1.8679 1.8679 1.9488 1.9488 2.0980 2.0980 2.6889 2.6889 5.0157 5.0157 5.8601 5.8601 6.1455 6.1455 8.7093 8.7093 8.8095 8.8095 9.3828 9.3828 9.6471 9.6471 k = 0.4236 0.2446 0.4536 ( 12612 PWs) bands (ev): -22.7089 -22.7089 -22.7089 -22.7089 -11.9504 -11.9504 -11.0783 -11.0783 -10.9344 -10.9344 -10.9076 -10.9076 -10.7486 -10.7486 -10.7048 -10.7048 -7.6921 -7.6921 -7.3898 -7.3898 -7.3779 -7.3779 -6.5222 -6.5222 -6.5208 -6.5208 -6.5105 -6.5105 -6.5056 -6.5056 -1.9330 -1.9330 -1.5759 -1.5759 -1.4276 -1.4276 0.2733 0.2733 0.3768 0.3768 0.5997 0.5997 0.7321 0.7321 0.8735 0.8735 1.0304 1.0304 1.1656 1.1656 1.2423 1.2423 1.5033 1.5033 1.6108 1.6108 1.7389 1.7389 1.8515 1.8515 1.9299 1.9299 2.1061 2.1061 2.7075 2.7075 5.0650 5.0650 5.8516 5.8516 6.1316 6.1316 8.7665 8.7665 8.8636 8.8636 9.3870 9.3870 9.7038 9.7038 k = 0.4167 0.2406 0.4763 ( 12596 PWs) bands (ev): -22.7090 -22.7090 -22.7089 -22.7089 -11.9486 -11.9486 -11.0725 -11.0725 -10.9407 -10.9407 -10.9112 -10.9112 -10.7527 -10.7527 -10.7012 -10.7012 -7.6891 -7.6891 -7.3894 -7.3894 -7.3770 -7.3770 -6.5212 -6.5212 -6.5199 -6.5199 -6.5105 -6.5105 -6.5053 -6.5053 -1.9166 -1.9166 -1.5809 -1.5809 -1.4353 -1.4353 0.2600 0.2600 0.3798 0.3798 0.5900 0.5900 0.7397 0.7397 0.8772 0.8772 1.0474 1.0474 1.1830 1.1830 1.2602 1.2602 1.4719 1.4719 1.5882 1.5882 1.7079 1.7079 1.8356 1.8356 1.9109 1.9109 2.1150 2.1150 2.7253 2.7253 5.1123 5.1123 5.8443 5.8443 6.1174 6.1174 8.8249 8.8249 8.9202 8.9202 9.3866 9.3866 9.7260 9.7260 k = 0.4097 0.2366 0.4990 ( 12600 PWs) bands (ev): -22.7090 -22.7090 -22.7089 -22.7089 -11.9469 -11.9469 -11.0665 -11.0665 -10.9466 -10.9466 -10.9148 -10.9148 -10.7571 -10.7571 -10.6975 -10.6975 -7.6863 -7.6863 -7.3891 -7.3891 -7.3762 -7.3762 -6.5204 -6.5204 -6.5190 -6.5190 -6.5105 -6.5105 -6.5050 -6.5050 -1.9010 -1.9010 -1.5850 -1.5850 -1.4428 -1.4428 0.2461 0.2461 0.3816 0.3816 0.5802 0.5802 0.7507 0.7507 0.8824 0.8824 1.0660 1.0660 1.1984 1.1984 1.2750 1.2750 1.4426 1.4426 1.5660 1.5660 1.6778 1.6778 1.8203 1.8203 1.8920 1.8920 2.1247 2.1247 2.7420 2.7420 5.1560 5.1560 5.8387 5.8387 6.1028 6.1028 8.8832 8.8832 8.9784 8.9784 9.3806 9.3806 9.7490 9.7490 k = 0.4028 0.2325 0.5217 ( 12592 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9454 -11.9454 -11.0605 -11.0605 -10.9519 -10.9519 -10.9184 -10.9184 -10.7619 -10.7619 -10.6939 -10.6939 -7.6836 -7.6836 -7.3888 -7.3888 -7.3754 -7.3754 -6.5197 -6.5197 -6.5182 -6.5182 -6.5106 -6.5106 -6.5045 -6.5045 -1.8867 -1.8867 -1.5879 -1.5879 -1.4500 -1.4500 0.2318 0.2318 0.3813 0.3813 0.5717 0.5717 0.7643 0.7643 0.8891 0.8891 1.0857 1.0857 1.2115 1.2115 1.2842 1.2842 1.4181 1.4181 1.5448 1.5448 1.6496 1.6496 1.8057 1.8057 1.8734 1.8734 2.1349 2.1349 2.7573 2.7573 5.1949 5.1949 5.8354 5.8354 6.0883 6.0883 8.9394 8.9394 9.0371 9.0371 9.3689 9.3689 9.7728 9.7728 k = 0.3958 0.2285 0.5443 ( 12594 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9440 -11.9440 -11.0546 -11.0546 -10.9564 -10.9564 -10.9219 -10.9219 -10.7669 -10.7669 -10.6902 -10.6902 -7.6813 -7.6813 -7.3885 -7.3885 -7.3747 -7.3747 -6.5191 -6.5191 -6.5176 -6.5176 -6.5107 -6.5107 -6.5041 -6.5041 -1.8740 -1.8740 -1.5895 -1.5895 -1.4567 -1.4567 0.2176 0.2176 0.3783 0.3783 0.5660 0.5660 0.7798 0.7798 0.8977 0.8977 1.1057 1.1057 1.2216 1.2216 1.2836 1.2836 1.4029 1.4029 1.5255 1.5255 1.6244 1.6244 1.7917 1.7917 1.8555 1.8555 2.1455 2.1455 2.7707 2.7707 5.2281 5.2281 5.8348 5.8348 6.0740 6.0740 8.9912 8.9912 9.0946 9.0946 9.3524 9.3524 9.7970 9.7970 k = 0.3889 0.2245 0.5670 ( 12597 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9429 -11.9429 -11.0490 -11.0490 -10.9599 -10.9599 -10.9253 -10.9253 -10.7722 -10.7722 -10.6866 -10.6866 -7.6792 -7.6792 -7.3883 -7.3883 -7.3741 -7.3741 -6.5188 -6.5188 -6.5170 -6.5170 -6.5107 -6.5107 -6.5035 -6.5035 -1.8635 -1.8635 -1.5899 -1.5899 -1.4627 -1.4627 0.2038 0.2038 0.3721 0.3721 0.5643 0.5643 0.7961 0.7961 0.9083 0.9083 1.1245 1.1245 1.2283 1.2283 1.2720 1.2720 1.3988 1.3988 1.5087 1.5087 1.6033 1.6033 1.7781 1.7781 1.8387 1.8387 2.1565 2.1565 2.7819 2.7819 5.2549 5.2549 5.8368 5.8368 6.0603 6.0603 9.0351 9.0351 9.1477 9.1477 9.3344 9.3344 9.8210 9.8210 k = 0.3819 0.2205 0.5897 ( 12608 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9420 -11.9420 -11.0438 -11.0438 -10.9622 -10.9622 -10.9286 -10.9286 -10.7775 -10.7775 -10.6831 -10.6831 -7.6776 -7.6776 -7.3883 -7.3883 -7.3737 -7.3737 -6.5186 -6.5186 -6.5165 -6.5165 -6.5108 -6.5108 -6.5030 -6.5030 -1.8552 -1.8552 -1.5894 -1.5894 -1.4678 -1.4678 0.1904 0.1904 0.3630 0.3630 0.5670 0.5670 0.8124 0.8124 0.9209 0.9209 1.1395 1.1395 1.2315 1.2315 1.2551 1.2551 1.4022 1.4022 1.4951 1.4951 1.5876 1.5876 1.7646 1.7646 1.8234 1.8234 2.1678 2.1678 2.7906 2.7906 5.2751 5.2751 5.8407 5.8407 6.0478 6.0478 9.0654 9.0654 9.1904 9.1904 9.3238 9.3238 9.8433 9.8433 k = 0.3750 0.2165 0.6124 ( 12600 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9415 -11.9415 -11.0394 -11.0394 -10.9630 -10.9630 -10.9318 -10.9318 -10.7830 -10.7830 -10.6796 -10.6796 -7.6765 -7.6765 -7.3883 -7.3883 -7.3733 -7.3733 -6.5187 -6.5187 -6.5162 -6.5162 -6.5109 -6.5109 -6.5025 -6.5025 -1.8492 -1.8492 -1.5885 -1.5885 -1.4715 -1.4715 0.1779 0.1779 0.3519 0.3519 0.5740 0.5740 0.8276 0.8276 0.9355 0.9355 1.1449 1.1449 1.2310 1.2310 1.2435 1.2435 1.4078 1.4078 1.4858 1.4858 1.5781 1.5781 1.7513 1.7513 1.8100 1.8100 2.1792 2.1792 2.7965 2.7965 5.2890 5.2890 5.8452 5.8452 6.0370 6.0370 9.0723 9.0723 9.2169 9.2169 9.3334 9.3334 9.8619 9.8619 k = 0.6250-0.0722 0.4082 ( 12600 PWs) bands (ev): -22.7090 -22.7090 -22.7088 -22.7088 -11.9415 -11.9415 -11.0394 -11.0394 -10.9630 -10.9630 -10.9318 -10.9318 -10.7830 -10.7830 -10.6796 -10.6796 -7.6765 -7.6765 -7.3883 -7.3883 -7.3733 -7.3733 -6.5187 -6.5187 -6.5162 -6.5162 -6.5109 -6.5109 -6.5025 -6.5025 -1.8492 -1.8492 -1.5885 -1.5885 -1.4715 -1.4715 0.1779 0.1779 0.3519 0.3519 0.5740 0.5740 0.8276 0.8276 0.9355 0.9355 1.1449 1.1449 1.2310 1.2310 1.2435 1.2435 1.4078 1.4078 1.4858 1.4858 1.5781 1.5781 1.7513 1.7513 1.8100 1.8100 2.1792 2.1792 2.7965 2.7965 5.2890 5.2890 5.8452 5.8452 6.0370 6.0370 9.0723 9.0723 9.2169 9.2169 9.3334 9.3334 9.8619 9.8619 k = 0.6136-0.0919 0.4082 ( 12614 PWs) bands (ev): -22.7091 -22.7091 -22.7087 -22.7087 -11.9411 -11.9411 -11.0324 -11.0324 -10.9631 -10.9631 -10.9366 -10.9366 -10.7920 -10.7920 -10.6742 -10.6742 -7.6752 -7.6752 -7.3884 -7.3884 -7.3728 -7.3728 -6.5191 -6.5191 -6.5157 -6.5157 -6.5111 -6.5111 -6.5017 -6.5017 -1.8415 -1.8415 -1.5878 -1.5878 -1.4758 -1.4758 0.1587 0.1587 0.3314 0.3314 0.5909 0.5909 0.8514 0.8514 0.9607 0.9607 1.1414 1.1414 1.2263 1.2263 1.2359 1.2359 1.4115 1.4115 1.4804 1.4804 1.5677 1.5677 1.7286 1.7286 1.7917 1.7917 2.1979 2.1979 2.8029 2.8029 5.3060 5.3060 5.8513 5.8513 6.0223 6.0223 9.0584 9.0584 9.2263 9.2263 9.3871 9.3871 9.8824 9.8824 k = 0.6023-0.1115 0.4082 ( 12620 PWs) bands (ev): -22.7091 -22.7091 -22.7087 -22.7087 -11.9408 -11.9408 -11.0248 -11.0248 -10.9633 -10.9633 -10.9410 -10.9410 -10.8011 -10.8011 -10.6691 -10.6691 -7.6740 -7.6740 -7.3886 -7.3886 -7.3725 -7.3725 -6.5195 -6.5195 -6.5153 -6.5153 -6.5113 -6.5113 -6.5009 -6.5009 -1.8346 -1.8346 -1.5880 -1.5880 -1.4782 -1.4782 0.1407 0.1407 0.3089 0.3089 0.6114 0.6114 0.8755 0.8755 0.9851 0.9851 1.1359 1.1359 1.2226 1.2226 1.2299 1.2299 1.4045 1.4045 1.4868 1.4868 1.5566 1.5566 1.7043 1.7043 1.7777 1.7777 2.2160 2.2160 2.8077 2.8077 5.3206 5.3206 5.8553 5.8553 6.0102 6.0102 9.0428 9.0428 9.2125 9.2125 9.4578 9.4578 9.8928 9.8928 k = 0.5909-0.1312 0.4082 ( 12600 PWs) bands (ev): -22.7091 -22.7091 -22.7087 -22.7087 -11.9407 -11.9407 -11.0168 -11.0168 -10.9635 -10.9635 -10.9451 -10.9451 -10.8104 -10.8104 -10.6644 -10.6644 -7.6731 -7.6731 -7.3888 -7.3888 -7.3721 -7.3721 -6.5200 -6.5200 -6.5151 -6.5151 -6.5114 -6.5114 -6.5001 -6.5001 -1.8287 -1.8287 -1.5891 -1.5891 -1.4790 -1.4790 0.1242 0.1242 0.2861 0.2861 0.6341 0.6341 0.8992 0.8992 1.0079 1.0079 1.1274 1.1274 1.2204 1.2204 1.2270 1.2270 1.3918 1.3918 1.4990 1.4990 1.5445 1.5445 1.6793 1.6793 1.7675 1.7675 2.2333 2.2333 2.8113 2.8113 5.3324 5.3324 5.8573 5.8573 6.0014 6.0014 9.0263 9.0263 9.1921 9.1921 9.5277 9.5277 9.8961 9.8961 k = 0.5795-0.1509 0.4082 ( 12598 PWs) bands (ev): -22.7092 -22.7092 -22.7087 -22.7087 -11.9407 -11.9407 -11.0085 -11.0085 -10.9637 -10.9637 -10.9486 -10.9486 -10.8198 -10.8198 -10.6601 -10.6601 -7.6724 -7.6724 -7.3890 -7.3890 -7.3719 -7.3719 -6.5205 -6.5205 -6.5149 -6.5149 -6.5115 -6.5115 -6.4994 -6.4994 -1.8239 -1.8239 -1.5905 -1.5905 -1.4784 -1.4784 0.1093 0.1093 0.2641 0.2641 0.6580 0.6580 0.9217 0.9217 1.0281 1.0281 1.1158 1.1158 1.2198 1.2198 1.2285 1.2285 1.3782 1.3782 1.5120 1.5120 1.5311 1.5311 1.6545 1.6545 1.7607 1.7607 2.2495 2.2495 2.8137 2.8137 5.3414 5.3414 5.8576 5.8576 5.9957 5.9957 9.0096 9.0096 9.1699 9.1699 9.5894 9.5894 9.8973 9.8973 k = 0.5682-0.1706 0.4082 ( 12602 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9408 -11.9408 -11.0002 -11.0002 -10.9639 -10.9639 -10.9515 -10.9515 -10.8290 -10.8290 -10.6562 -10.6562 -7.6718 -7.6718 -7.3893 -7.3893 -7.3717 -7.3717 -6.5210 -6.5210 -6.5148 -6.5148 -6.5116 -6.5116 -6.4988 -6.4988 -1.8202 -1.8202 -1.5920 -1.5920 -1.4770 -1.4770 0.0960 0.0960 0.2437 0.2437 0.6825 0.6825 0.9424 0.9424 1.0448 1.0448 1.1016 1.1016 1.2209 1.2209 1.2344 1.2344 1.3657 1.3657 1.5160 1.5160 1.5235 1.5235 1.6312 1.6312 1.7569 1.7569 2.2644 2.2644 2.8154 2.8154 5.3475 5.3475 5.8568 5.8568 5.9928 5.9928 8.9935 8.9935 9.1479 9.1479 9.6379 9.6379 9.9022 9.9022 k = 0.5568-0.1903 0.4082 ( 12610 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9409 -11.9409 -10.9922 -10.9922 -10.9640 -10.9640 -10.9538 -10.9538 -10.8380 -10.8380 -10.6529 -10.6529 -7.6714 -7.6714 -7.3895 -7.3895 -7.3715 -7.3715 -6.5215 -6.5215 -6.5147 -6.5147 -6.5117 -6.5117 -6.4983 -6.4983 -1.8175 -1.8175 -1.5932 -1.5932 -1.4751 -1.4751 0.0846 0.0846 0.2255 0.2255 0.7068 0.7068 0.9605 0.9605 1.0577 1.0577 1.0861 1.0861 1.2239 1.2239 1.2434 1.2434 1.3557 1.3557 1.4990 1.4990 1.5326 1.5326 1.6103 1.6103 1.7556 1.7556 2.2775 2.2775 2.8163 2.8163 5.3511 5.3511 5.8556 5.8556 5.9919 5.9919 8.9787 8.9787 9.1272 9.1272 9.6694 9.6694 9.9142 9.9142 k = 0.5455-0.2099 0.4082 ( 12612 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9411 -11.9411 -10.9849 -10.9849 -10.9640 -10.9640 -10.9556 -10.9556 -10.8464 -10.8464 -10.6502 -10.6502 -7.6710 -7.6710 -7.3897 -7.3897 -7.3714 -7.3714 -6.5219 -6.5219 -6.5146 -6.5146 -6.5117 -6.5117 -6.4978 -6.4978 -1.8157 -1.8157 -1.5941 -1.5941 -1.4730 -1.4730 0.0751 0.0751 0.2101 0.2101 0.7301 0.7301 0.9749 0.9749 1.0667 1.0667 1.0710 1.0710 1.2288 1.2288 1.2536 1.2536 1.3495 1.3495 1.4799 1.4799 1.5393 1.5393 1.5926 1.5926 1.7560 1.7560 2.2886 2.2886 2.8169 2.8169 5.3529 5.3529 5.8544 5.8544 5.9923 5.9923 8.9658 8.9658 9.1090 9.1090 9.6852 9.6852 9.9306 9.9308 k = 0.5341-0.2296 0.4082 ( 12610 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9412 -11.9412 -10.9791 -10.9791 -10.9632 -10.9632 -10.9567 -10.9567 -10.8539 -10.8539 -10.6480 -10.6480 -7.6708 -7.6708 -7.3899 -7.3899 -7.3713 -7.3713 -6.5222 -6.5222 -6.5146 -6.5146 -6.5117 -6.5117 -6.4975 -6.4975 -1.8146 -1.8146 -1.5947 -1.5947 -1.4710 -1.4710 0.0676 0.0676 0.1977 0.1977 0.7511 0.7511 0.9844 0.9844 1.0586 1.0586 1.0723 1.0723 1.2351 1.2351 1.2618 1.2618 1.3494 1.3494 1.4589 1.4589 1.5438 1.5438 1.5787 1.5787 1.7574 1.7574 2.2976 2.2976 2.8171 2.8171 5.3533 5.3533 5.8534 5.8534 5.9934 5.9934 8.9553 8.9553 9.0940 9.0940 9.6905 9.6905 9.9277 9.9277 k = 0.5227-0.2493 0.4082 ( 12614 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9413 -11.9413 -10.9754 -10.9754 -10.9616 -10.9616 -10.9574 -10.9574 -10.8601 -10.8601 -10.6464 -10.6464 -7.6706 -7.6706 -7.3901 -7.3901 -7.3712 -7.3712 -6.5225 -6.5225 -6.5146 -6.5146 -6.5117 -6.5117 -6.4972 -6.4972 -1.8140 -1.8140 -1.5950 -1.5950 -1.4695 -1.4695 0.0622 0.0622 0.1887 0.1887 0.7684 0.7684 0.9881 0.9881 1.0510 1.0510 1.0753 1.0753 1.2422 1.2422 1.2653 1.2653 1.3570 1.3570 1.4367 1.4367 1.5463 1.5463 1.5691 1.5691 1.7590 1.7590 2.3041 2.3041 2.8172 2.8172 5.3531 5.3531 5.8528 5.8528 5.9944 5.9944 8.9475 8.9475 9.0828 9.0828 9.6909 9.6909 9.9245 9.9245 k = 0.5114-0.2690 0.4082 ( 12602 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9414 -11.9414 -10.9739 -10.9739 -10.9597 -10.9597 -10.9577 -10.9577 -10.8641 -10.8641 -10.6455 -10.6455 -7.6705 -7.6705 -7.3901 -7.3901 -7.3712 -7.3712 -6.5226 -6.5226 -6.5146 -6.5146 -6.5117 -6.5117 -6.4971 -6.4971 -1.8137 -1.8137 -1.5952 -1.5952 -1.4685 -1.4685 0.0589 0.0589 0.1833 0.1833 0.7801 0.7801 0.9876 0.9876 1.0481 1.0481 1.0766 1.0766 1.2493 1.2493 1.2641 1.2641 1.3717 1.3717 1.4142 1.4142 1.5472 1.5472 1.5637 1.5637 1.7602 1.7602 2.3081 2.3081 2.8172 2.8172 5.3527 5.3527 5.8525 5.8525 5.9952 5.9952 8.9427 8.9427 9.0759 9.0759 9.6899 9.6899 9.9225 9.9225 k = 0.5000-0.2887 0.4082 ( 12558 PWs) bands (ev): -22.7092 -22.7092 -22.7086 -22.7086 -11.9414 -11.9414 -10.9735 -10.9735 -10.9590 -10.9590 -10.9576 -10.9576 -10.8656 -10.8656 -10.6452 -10.6452 -7.6705 -7.6705 -7.3902 -7.3902 -7.3711 -7.3711 -6.5227 -6.5227 -6.5146 -6.5146 -6.5117 -6.5117 -6.4970 -6.4970 -1.8136 -1.8136 -1.5952 -1.5952 -1.4681 -1.4681 0.0578 0.0578 0.1814 0.1814 0.7842 0.7842 0.9868 0.9868 1.0475 1.0475 1.0770 1.0770 1.2533 1.2533 1.2618 1.2618 1.3870 1.3870 1.3965 1.3965 1.5473 1.5473 1.5620 1.5620 1.7607 1.7607 2.3095 2.3095 2.8172 2.8172 5.3525 5.3525 5.8524 5.8524 5.9955 5.9955 8.9411 8.9411 9.0736 9.0736 9.6894 9.6894 9.9219 9.9219 Writing output data file Rb2TeBr6.save init_run : 0.42s CPU 0.57s WALL ( 1 calls) electrons : 377.05s CPU 380.93s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.04s CPU 0.09s WALL ( 1 calls) Called by electrons: c_bands : 377.04s CPU 380.92s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.07s CPU 0.10s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.08s WALL ( 202 calls) cegterg : 353.29s CPU 356.44s WALL ( 451 calls) Called by sum_band: Called by *egterg: h_psi : 202.04s CPU 204.99s WALL ( 6920 calls) s_psi : 7.65s CPU 7.46s WALL ( 6920 calls) g_psi : 0.37s CPU 0.33s WALL ( 6267 calls) cdiaghg : 124.56s CPU 124.86s WALL ( 6469 calls) cegterg:over : 16.21s CPU 16.24s WALL ( 6267 calls) cegterg:upda : 11.32s CPU 11.56s WALL ( 6267 calls) cegterg:last : 5.92s CPU 6.00s WALL ( 855 calls) cdiaghg:chol : 4.86s CPU 4.99s WALL ( 6469 calls) cdiaghg:inve : 3.74s CPU 3.64s WALL ( 6469 calls) cdiaghg:para : 7.47s CPU 7.53s WALL ( 12938 calls) Called by h_psi: h_psi:vloc : 183.87s CPU 186.64s WALL ( 6920 calls) h_psi:vnl : 17.74s CPU 17.91s WALL ( 6920 calls) add_vuspsi : 8.47s CPU 8.50s WALL ( 6920 calls) General routines calbec : 9.22s CPU 9.39s WALL ( 6920 calls) fft : 0.02s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 176.00s CPU 178.37s WALL ( 802340 calls) interpolate : 0.00s CPU 0.01s WALL ( 4 calls) davcio : 0.17s CPU 0.28s WALL ( 404 calls) Parallel routines fft_scatter : 111.50s CPU 112.96s WALL ( 802363 calls) PWSCF : 7m 5.25s CPU 7m23.81s WALL This run was terminated on: 4:30:12 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=