Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 19:41:50
This program is part of the open-source Quantum ESPRESSO suite
for quantum simulation of materials; please cite
"P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009);
URL http://www.quantum-espresso.org",
in publications or presentations arising from this work. More details at
http://www.quantum-espresso.org/quote
Parallel version (MPI), running on 36 processors
R & G space division: proc/nbgrp/npool/nimage = 36
Waiting for input...
Reading input from standard input
Current dimensions of program PWSCF are:
Max number of different atomic species (ntypx) = 10
Max number of k-points (npk) = 40000
Max angular momentum in pseudopotentials (lmaxx) = 3
Atomic positions and unit cell read from directory:
./YAlZn.save/
file Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized
file Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P renormalized
Subspace diagonalization in iterative solution of the eigenvalue problem:
one sub-group per k-point group (pool) will be used
scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs)
Parallelization info
--------------------
sticks: dense smooth PW G-vecs: dense smooth PW
Min 38 24 7 1804 937 149
Max 39 25 8 1811 955 158
Sum 1369 889 253 64991 34113 5431
bravais-lattice index = 14
lattice parameter (alat) = 8.4773 a.u.
unit-cell volume = 839.0325 (a.u.)^3
number of atoms/cell = 6
number of atomic types = 3
number of electrons = 52.00
number of Kohn-Sham states= 62
kinetic-energy cutoff = 45.0000 Ry
charge density cutoff = 276.0000 Ry
Exchange-correlation = PBE ( 1 4 3 4 0 0)
Non magnetic calculation with spin-orbit
celldm(1)= 8.477311 celldm(2)= 1.000000 celldm(3)= 1.590281
celldm(4)= 0.000000 celldm(5)= 0.000000 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) = ( 0.000000 0.000000 1.590281 )
reciprocal axes: (cart. coord. in units 2 pi/alat)
b(1) = ( 1.000000 0.577350 -0.000000 )
b(2) = ( 0.000000 1.154701 -0.000000 )
b(3) = ( 0.000000 0.000000 0.628820 )
PseudoPot. # 1 for Al read from file:
/users/gautes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF
MD5 check sum: d344aa71f13a435d235890da883ec65e
Pseudo is Ultrasoft + core correction, Zval = 3.0
Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656
Using radial grid of 1135 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. # 2 for Zn read from file:
/users/gautes/Pseudo/Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF
MD5 check sum: 8d14e5a70806ad8c3d477ea097862760
Pseudo is Ultrasoft + core correction, Zval = 12.0
Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656
Using radial grid of 1201 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 Y read from file:
/users/gautes/Pseudo/Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF
MD5 check sum: 25a826a599bbcba7ebf619f9598d90b1
Pseudo is Ultrasoft + core correction, Zval = 11.0
Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656
Using radial grid of 1223 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
Al 3.00 26.98150 Al( 1.00)
Zn 12.00 65.40900 Zn( 1.00)
Y 11.00 88.90590 Y( 1.00)
24 Sym. Ops., with inversion, found (12 have fractional translation)
s frac. trans.
isym = 1 identity
cryst. s( 1) = ( 1 0 0 )
( 0 1 0 )
( 0 0 1 )
cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 )
( 0.0000000 1.0000000 0.0000000 )
( 0.0000000 0.0000000 1.0000000 )
isym = 2 180 deg rotation - cart. axis [0,0,1]
cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 )
( 0 -1 0 ) ( 0.0000000 )
( 0 0 1 ) ( 0.5000000 )
cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.0000000 )
( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 )
( 0.0000000 0.0000000 1.0000000 ) ( 0.7951404 )
isym = 3 180 deg rotation - cart. axis [0,1,0]
cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 )
( 1 1 0 ) ( 0.0000000 )
( 0 0 -1 ) ( 0.5000000 )
cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 )
( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 )
( 0.0000000 0.0000000 -1.0000000 ) ( 0.7951404 )
isym = 4 180 deg rotation - cart. axis [1,0,0]
cryst. s( 4) = ( 1 0 0 )
( -1 -1 0 )
( 0 0 -1 )
cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 )
( 0.0000000 -1.0000000 -0.0000000 )
( 0.0000000 0.0000000 -1.0000000 )
isym = 5 60 deg rotation - cryst. axis [0,0,1]
cryst. s( 5) = ( 1 1 0 ) f =( 0.0000000 )
( -1 0 0 ) ( 0.0000000 )
( 0 0 1 ) ( 0.5000000 )
cart. s( 5) = ( 0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 )
( 0.8660254 0.5000000 0.0000000 ) ( 0.0000000 )
( 0.0000000 0.0000000 1.0000000 ) ( 0.7951404 )
isym = 6 60 deg rotation - cryst. axis [0,0,-1]
cryst. s( 6) = ( 0 -1 0 ) f =( 0.0000000 )
( 1 1 0 ) ( 0.0000000 )
( 0 0 1 ) ( 0.5000000 )
cart. s( 6) = ( 0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 )
( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 )
( 0.0000000 0.0000000 1.0000000 ) ( 0.7951404 )
isym = 7 120 deg rotation - cryst. axis [0,0,1]
cryst. s( 7) = ( 0 1 0 )
( -1 -1 0 )
( 0 0 1 )
cart. s( 7) = ( -0.5000000 -0.8660254 0.0000000 )
( 0.8660254 -0.5000000 0.0000000 )
( 0.0000000 0.0000000 1.0000000 )
isym = 8 120 deg rotation - cryst. axis [0,0,-1]
cryst. s( 8) = ( -1 -1 0 )
( 1 0 0 )
( 0 0 1 )
cart. s( 8) = ( -0.5000000 0.8660254 0.0000000 )
( -0.8660254 -0.5000000 0.0000000 )
( 0.0000000 0.0000000 1.0000000 )
isym = 9 180 deg rotation - cryst. axis [1,-1,0]
cryst. s( 9) = ( 0 -1 0 ) f =( 0.0000000 )
( -1 0 0 ) ( 0.0000000 )
( 0 0 -1 ) ( 0.5000000 )
cart. s( 9) = ( 0.5000000 -0.8660254 -0.0000000 ) f =( 0.0000000 )
( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 )
( 0.0000000 0.0000000 -1.0000000 ) ( 0.7951404 )
isym = 10 180 deg rotation - cryst. axis [2,1,0]
cryst. s(10) = ( 1 1 0 ) f =( 0.0000000 )
( 0 -1 0 ) ( 0.0000000 )
( 0 0 -1 ) ( 0.5000000 )
cart. s(10) = ( 0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 )
( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 )
( 0.0000000 0.0000000 -1.0000000 ) ( 0.7951404 )
isym = 11 180 deg rotation - cryst. axis [0,1,0]
cryst. s(11) = ( -1 -1 0 )
( 0 1 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 = 12 180 deg rotation - cryst. axis [1,1,0]
cryst. s(12) = ( 0 1 0 )
( 1 0 0 )
( 0 0 -1 )
cart. s(12) = ( -0.5000000 0.8660254 -0.0000000 )
( 0.8660254 0.5000000 -0.0000000 )
( 0.0000000 0.0000000 -1.0000000 )
isym = 13 inversion
cryst. s(13) = ( -1 0 0 )
( 0 -1 0 )
( 0 0 -1 )
cart. s(13) = ( -1.0000000 0.0000000 -0.0000000 )
( 0.0000000 -1.0000000 -0.0000000 )
( 0.0000000 0.0000000 -1.0000000 )
isym = 14 inv. 180 deg rotation - cart. axis [0,0,1]
cryst. s(14) = ( 1 0 0 ) f =( 0.0000000 )
( 0 1 0 ) ( 0.0000000 )
( 0 0 -1 ) ( 0.5000000 )
cart. s(14) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 )
( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 )
( 0.0000000 0.0000000 -1.0000000 ) ( 0.7951404 )
isym = 15 inv. 180 deg rotation - cart. axis [0,1,0]
cryst. s(15) = ( 1 0 0 ) f =( 0.0000000 )
( -1 -1 0 ) ( 0.0000000 )
( 0 0 1 ) ( 0.5000000 )
cart. s(15) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 )
( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 )
( 0.0000000 0.0000000 1.0000000 ) ( 0.7951404 )
isym = 16 inv. 180 deg rotation - cart. axis [1,0,0]
cryst. s(16) = ( -1 0 0 )
( 1 1 0 )
( 0 0 1 )
cart. s(16) = ( -1.0000000 0.0000000 0.0000000 )
( 0.0000000 1.0000000 0.0000000 )
( 0.0000000 0.0000000 1.0000000 )
isym = 17 inv. 60 deg rotation - cryst. axis [0,0,1]
cryst. s(17) = ( -1 -1 0 ) f =( 0.0000000 )
( 1 0 0 ) ( 0.0000000 )
( 0 0 -1 ) ( 0.5000000 )
cart. s(17) = ( -0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 )
( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 )
( 0.0000000 0.0000000 -1.0000000 ) ( 0.7951404 )
isym = 18 inv. 60 deg rotation - cryst. axis [0,0,-1]
cryst. s(18) = ( 0 1 0 ) f =( 0.0000000 )
( -1 -1 0 ) ( 0.0000000 )
( 0 0 -1 ) ( 0.5000000 )
cart. s(18) = ( -0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 )
( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 )
( 0.0000000 0.0000000 -1.0000000 ) ( 0.7951404 )
isym = 19 inv. 120 deg rotation - cryst. axis [0,0,1]
cryst. s(19) = ( 0 -1 0 )
( 1 1 0 )
( 0 0 -1 )
cart. s(19) = ( 0.5000000 0.8660254 -0.0000000 )
( -0.8660254 0.5000000 -0.0000000 )
( 0.0000000 0.0000000 -1.0000000 )
isym = 20 inv. 120 deg rotation - cryst. axis [0,0,-1]
cryst. s(20) = ( 1 1 0 )
( -1 0 0 )
( 0 0 -1 )
cart. s(20) = ( 0.5000000 -0.8660254 -0.0000000 )
( 0.8660254 0.5000000 -0.0000000 )
( 0.0000000 0.0000000 -1.0000000 )
isym = 21 inv. 180 deg rotation - cryst. axis [1,-1,0]
cryst. s(21) = ( 0 1 0 ) f =( 0.0000000 )
( 1 0 0 ) ( 0.0000000 )
( 0 0 1 ) ( 0.5000000 )
cart. s(21) = ( -0.5000000 0.8660254 0.0000000 ) f =( 0.0000000 )
( 0.8660254 0.5000000 0.0000000 ) ( 0.0000000 )
( 0.0000000 0.0000000 1.0000000 ) ( 0.7951404 )
isym = 22 inv. 180 deg rotation - cryst. axis [2,1,0]
cryst. s(22) = ( -1 -1 0 ) f =( 0.0000000 )
( 0 1 0 ) ( 0.0000000 )
( 0 0 1 ) ( 0.5000000 )
cart. s(22) = ( -0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 )
( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 )
( 0.0000000 0.0000000 1.0000000 ) ( 0.7951404 )
isym = 23 inv. 180 deg rotation - cryst. axis [0,1,0]
cryst. s(23) = ( 1 1 0 )
( 0 -1 0 )
( 0 0 1 )
cart. s(23) = ( 0.5000000 0.8660254 -0.0000000 )
( 0.8660254 -0.5000000 0.0000000 )
( 0.0000000 0.0000000 1.0000000 )
isym = 24 inv. 180 deg rotation - cryst. axis [1,1,0]
cryst. s(24) = ( 0 -1 0 )
( -1 0 0 )
( 0 0 1 )
cart. s(24) = ( 0.5000000 -0.8660254 0.0000000 )
( -0.8660254 -0.5000000 0.0000000 )
( 0.0000000 0.0000000 1.0000000 )
double point group D_6h(6/mmm)
there are 18 classes and 6 irreducible representations
the character table:
E -E 2C6 -2C6 2C3 -2C3 C2 3C2' 3C2'' i -i 2S3
-C2 -3C2' -3C2'
G_7+ 2.00 -2.00 1.73 -1.73 1.00 -1.00 0.00 0.00 0.00 2.00 -2.00 1.73
G_8+ 2.00 -2.00 -1.73 1.73 1.00 -1.00 0.00 0.00 0.00 2.00 -2.00 -1.73
G_9+ 2.00 -2.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 2.00 -2.00 0.00
G_7- 2.00 -2.00 1.73 -1.73 1.00 -1.00 0.00 0.00 0.00 -2.00 2.00 -1.73
G_8- 2.00 -2.00 -1.73 1.73 1.00 -1.00 0.00 0.00 0.00 -2.00 2.00 1.73
G_9- 2.00 -2.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 -2.00 2.00 0.00
-2S3 2S6 -2S6 s_h 3s_v 3s_d
-s_h -3s_v -3s_d
G_7+ -1.73 1.00 -1.00 0.00 0.00 0.00
G_8+ 1.73 1.00 -1.00 0.00 0.00 0.00
G_9+ 0.00 -2.00 2.00 0.00 0.00 0.00
G_7- 1.73 -1.00 1.00 0.00 0.00 0.00
G_8- -1.73 -1.00 1.00 0.00 0.00 0.00
G_9- 0.00 2.00 -2.00 0.00 0.00 0.00
the symmetry operations in each class and the name of the first element:
E 1
identity
-E -1
identity E
2C6 5 6
60 deg rotation - cryst. axis [0,0,1]
-2C6 -5 -6
60 deg rotation - cryst. axis [0,0,1] E
2C3 7 8
120 deg rotation - cryst. axis [0,0,1]
-2C3 -7 -8
120 deg rotation - cryst. axis [0,0,1] E
C2 -C2 2 -2
180 deg rotation - cart. axis [0,0,1]
3C2'-3C2' 4 -4 12 -11 11 -12
180 deg rotation - cart. axis [1,0,0]
3C2''-3C2' 3 -3 9 10 -10 -9
180 deg rotation - cart. axis [0,1,0]
i 13
inversion
-i -13
inversion E
2S3 17 18
inv. 60 deg rotation - cryst. axis [0,0,1]
-2S3 -17 -18
inv. 60 deg rotation - cryst. axis [0,0,1] E
2S6 19 20
inv. 120 deg rotation - cryst. axis [0,0,1]
-2S6 -19 -20
inv. 120 deg rotation - cryst. axis [0,0,1] E
s_h -s_h 14 -14
inv. 180 deg rotation - cart. axis [0,0,1]
3s_v-3s_v 16 -16 24 -23 23 -24
inv. 180 deg rotation - cart. axis [1,0,0]
3s_d-3s_d 15 -15 21 22 -22 -21
inv. 180 deg rotation - cart. axis [0,1,0]
Cartesian axes
number of k points= 302 Fermi-Dirac smearing, width (Ry)= 0.0010
cart. coord. in units 2pi/alat
k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033113
k( 2) = ( 0.0121951 0.0070409 -0.0000000), wk = 0.0033113
k( 3) = ( 0.0243902 0.0140817 -0.0000000), wk = 0.0033113
k( 4) = ( 0.0365854 0.0211226 -0.0000000), wk = 0.0033113
k( 5) = ( 0.0487805 0.0281634 -0.0000000), wk = 0.0033113
k( 6) = ( 0.0609756 0.0352043 -0.0000000), wk = 0.0033113
k( 7) = ( 0.0731707 0.0422451 -0.0000000), wk = 0.0033113
k( 8) = ( 0.0853658 0.0492860 -0.0000000), wk = 0.0033113
k( 9) = ( 0.0975610 0.0563269 -0.0000000), wk = 0.0033113
k( 10) = ( 0.1097561 0.0633677 -0.0000000), wk = 0.0033113
k( 11) = ( 0.1219512 0.0704086 -0.0000000), wk = 0.0033113
k( 12) = ( 0.1341463 0.0774494 -0.0000000), wk = 0.0033113
k( 13) = ( 0.1463415 0.0844903 -0.0000000), wk = 0.0033113
k( 14) = ( 0.1585366 0.0915311 -0.0000000), wk = 0.0033113
k( 15) = ( 0.1707317 0.0985720 -0.0000000), wk = 0.0033113
k( 16) = ( 0.1829268 0.1056129 -0.0000000), wk = 0.0033113
k( 17) = ( 0.1951219 0.1126537 -0.0000000), wk = 0.0033113
k( 18) = ( 0.2073171 0.1196946 -0.0000000), wk = 0.0033113
k( 19) = ( 0.2195122 0.1267354 -0.0000000), wk = 0.0033113
k( 20) = ( 0.2317073 0.1337763 -0.0000000), wk = 0.0033113
k( 21) = ( 0.2439024 0.1408171 -0.0000000), wk = 0.0033113
k( 22) = ( 0.2560976 0.1478580 -0.0000000), wk = 0.0033113
k( 23) = ( 0.2682927 0.1548989 -0.0000000), wk = 0.0033113
k( 24) = ( 0.2804878 0.1619397 -0.0000000), wk = 0.0033113
k( 25) = ( 0.2926829 0.1689806 -0.0000000), wk = 0.0033113
k( 26) = ( 0.3048781 0.1760214 -0.0000000), wk = 0.0033113
k( 27) = ( 0.3170732 0.1830623 -0.0000000), wk = 0.0033113
k( 28) = ( 0.3292683 0.1901031 -0.0000000), wk = 0.0033113
k( 29) = ( 0.3414634 0.1971440 -0.0000000), wk = 0.0033113
k( 30) = ( 0.3536585 0.2041849 -0.0000000), wk = 0.0033113
k( 31) = ( 0.3658537 0.2112257 -0.0000000), wk = 0.0033113
k( 32) = ( 0.3780488 0.2182666 -0.0000000), wk = 0.0033113
k( 33) = ( 0.3902439 0.2253074 -0.0000000), wk = 0.0033113
k( 34) = ( 0.4024390 0.2323483 -0.0000000), wk = 0.0033113
k( 35) = ( 0.4146341 0.2393891 -0.0000000), wk = 0.0033113
k( 36) = ( 0.4268293 0.2464300 -0.0000000), wk = 0.0033113
k( 37) = ( 0.4390244 0.2534708 -0.0000000), wk = 0.0033113
k( 38) = ( 0.4512195 0.2605117 -0.0000000), wk = 0.0033113
k( 39) = ( 0.4634146 0.2675526 -0.0000000), wk = 0.0033113
k( 40) = ( 0.4756098 0.2745934 -0.0000000), wk = 0.0033113
k( 41) = ( 0.4878049 0.2816343 -0.0000000), wk = 0.0033113
k( 42) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0033113
k( 43) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0033113
k( 44) = ( 0.4930556 0.3007033 -0.0000000), wk = 0.0033113
k( 45) = ( 0.4861111 0.3127314 -0.0000000), wk = 0.0033113
k( 46) = ( 0.4791667 0.3247595 -0.0000000), wk = 0.0033113
k( 47) = ( 0.4722222 0.3367877 -0.0000000), wk = 0.0033113
k( 48) = ( 0.4652778 0.3488158 -0.0000000), wk = 0.0033113
k( 49) = ( 0.4583333 0.3608439 -0.0000000), wk = 0.0033113
k( 50) = ( 0.4513889 0.3728720 -0.0000000), wk = 0.0033113
k( 51) = ( 0.4444444 0.3849002 -0.0000000), wk = 0.0033113
k( 52) = ( 0.4375000 0.3969283 -0.0000000), wk = 0.0033113
k( 53) = ( 0.4305556 0.4089564 -0.0000000), wk = 0.0033113
k( 54) = ( 0.4236111 0.4209846 -0.0000000), wk = 0.0033113
k( 55) = ( 0.4166667 0.4330127 -0.0000000), wk = 0.0033113
k( 56) = ( 0.4097222 0.4450408 -0.0000000), wk = 0.0033113
k( 57) = ( 0.4027778 0.4570690 -0.0000000), wk = 0.0033113
k( 58) = ( 0.3958333 0.4690971 -0.0000000), wk = 0.0033113
k( 59) = ( 0.3888889 0.4811252 -0.0000000), wk = 0.0033113
k( 60) = ( 0.3819444 0.4931534 -0.0000000), wk = 0.0033113
k( 61) = ( 0.3750000 0.5051815 -0.0000000), wk = 0.0033113
k( 62) = ( 0.3680556 0.5172096 -0.0000000), wk = 0.0033113
k( 63) = ( 0.3611111 0.5292377 -0.0000000), wk = 0.0033113
k( 64) = ( 0.3541667 0.5412659 -0.0000000), wk = 0.0033113
k( 65) = ( 0.3472222 0.5532940 -0.0000000), wk = 0.0033113
k( 66) = ( 0.3402778 0.5653221 -0.0000000), wk = 0.0033113
k( 67) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0033113
k( 68) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0033113
k( 69) = ( 0.3262411 0.5650662 -0.0000000), wk = 0.0033113
k( 70) = ( 0.3191489 0.5527822 -0.0000000), wk = 0.0033113
k( 71) = ( 0.3120567 0.5404981 -0.0000000), wk = 0.0033113
k( 72) = ( 0.3049645 0.5282141 -0.0000000), wk = 0.0033113
k( 73) = ( 0.2978723 0.5159300 -0.0000000), wk = 0.0033113
k( 74) = ( 0.2907801 0.5036460 -0.0000000), wk = 0.0033113
k( 75) = ( 0.2836879 0.4913619 -0.0000000), wk = 0.0033113
k( 76) = ( 0.2765957 0.4790779 -0.0000000), wk = 0.0033113
k( 77) = ( 0.2695035 0.4667938 -0.0000000), wk = 0.0033113
k( 78) = ( 0.2624113 0.4545098 -0.0000000), wk = 0.0033113
k( 79) = ( 0.2553191 0.4422257 -0.0000000), wk = 0.0033113
k( 80) = ( 0.2482270 0.4299417 -0.0000000), wk = 0.0033113
k( 81) = ( 0.2411348 0.4176576 -0.0000000), wk = 0.0033113
k( 82) = ( 0.2340425 0.4053736 -0.0000000), wk = 0.0033113
k( 83) = ( 0.2269503 0.3930895 -0.0000000), wk = 0.0033113
k( 84) = ( 0.2198582 0.3808055 -0.0000000), wk = 0.0033113
k( 85) = ( 0.2127660 0.3685215 -0.0000000), wk = 0.0033113
k( 86) = ( 0.2056738 0.3562374 -0.0000000), wk = 0.0033113
k( 87) = ( 0.1985816 0.3439534 -0.0000000), wk = 0.0033113
k( 88) = ( 0.1914894 0.3316693 -0.0000000), wk = 0.0033113
k( 89) = ( 0.1843972 0.3193852 -0.0000000), wk = 0.0033113
k( 90) = ( 0.1773050 0.3071012 -0.0000000), wk = 0.0033113
k( 91) = ( 0.1702128 0.2948172 -0.0000000), wk = 0.0033113
k( 92) = ( 0.1631206 0.2825331 -0.0000000), wk = 0.0033113
k( 93) = ( 0.1560284 0.2702491 -0.0000000), wk = 0.0033113
k( 94) = ( 0.1489362 0.2579650 -0.0000000), wk = 0.0033113
k( 95) = ( 0.1418440 0.2456810 -0.0000000), wk = 0.0033113
k( 96) = ( 0.1347518 0.2333969 -0.0000000), wk = 0.0033113
k( 97) = ( 0.1276596 0.2211129 -0.0000000), wk = 0.0033113
k( 98) = ( 0.1205674 0.2088288 -0.0000000), wk = 0.0033113
k( 99) = ( 0.1134752 0.1965448 -0.0000000), wk = 0.0033113
k( 100) = ( 0.1063830 0.1842607 -0.0000000), wk = 0.0033113
k( 101) = ( 0.0992908 0.1719767 -0.0000000), wk = 0.0033113
k( 102) = ( 0.0921986 0.1596926 -0.0000000), wk = 0.0033113
k( 103) = ( 0.0851064 0.1474086 -0.0000000), wk = 0.0033113
k( 104) = ( 0.0780142 0.1351245 -0.0000000), wk = 0.0033113
k( 105) = ( 0.0709220 0.1228405 -0.0000000), wk = 0.0033113
k( 106) = ( 0.0638298 0.1105564 -0.0000000), wk = 0.0033113
k( 107) = ( 0.0567376 0.0982724 -0.0000000), wk = 0.0033113
k( 108) = ( 0.0496454 0.0859883 -0.0000000), wk = 0.0033113
k( 109) = ( 0.0425532 0.0737043 -0.0000000), wk = 0.0033113
k( 110) = ( 0.0354610 0.0614202 -0.0000000), wk = 0.0033113
k( 111) = ( 0.0283688 0.0491362 -0.0000000), wk = 0.0033113
k( 112) = ( 0.0212766 0.0368522 -0.0000000), wk = 0.0033113
k( 113) = ( 0.0141844 0.0245681 -0.0000000), wk = 0.0033113
k( 114) = ( 0.0070922 0.0122841 -0.0000000), wk = 0.0033113
k( 115) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033113
k( 116) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033113
k( 117) = ( 0.0000000 0.0000000 0.0136700), wk = 0.0033113
k( 118) = ( 0.0000000 0.0000000 0.0273400), wk = 0.0033113
k( 119) = ( 0.0000000 0.0000000 0.0410100), wk = 0.0033113
k( 120) = ( 0.0000000 0.0000000 0.0546800), wk = 0.0033113
k( 121) = ( 0.0000000 0.0000000 0.0683500), wk = 0.0033113
k( 122) = ( 0.0000000 0.0000000 0.0820200), wk = 0.0033113
k( 123) = ( 0.0000000 0.0000000 0.0956900), wk = 0.0033113
k( 124) = ( 0.0000000 0.0000000 0.1093600), wk = 0.0033113
k( 125) = ( 0.0000000 0.0000000 0.1230299), wk = 0.0033113
k( 126) = ( 0.0000000 0.0000000 0.1366999), wk = 0.0033113
k( 127) = ( 0.0000000 0.0000000 0.1503699), wk = 0.0033113
k( 128) = ( 0.0000000 0.0000000 0.1640399), wk = 0.0033113
k( 129) = ( 0.0000000 0.0000000 0.1777099), wk = 0.0033113
k( 130) = ( 0.0000000 0.0000000 0.1913799), wk = 0.0033113
k( 131) = ( 0.0000000 0.0000000 0.2050499), wk = 0.0033113
k( 132) = ( 0.0000000 0.0000000 0.2187199), wk = 0.0033113
k( 133) = ( 0.0000000 0.0000000 0.2323899), wk = 0.0033113
k( 134) = ( 0.0000000 0.0000000 0.2460599), wk = 0.0033113
k( 135) = ( 0.0000000 0.0000000 0.2597299), wk = 0.0033113
k( 136) = ( 0.0000000 0.0000000 0.2733999), wk = 0.0033113
k( 137) = ( 0.0000000 0.0000000 0.2870699), wk = 0.0033113
k( 138) = ( 0.0000000 0.0000000 0.3007399), wk = 0.0033113
k( 139) = ( 0.0000000 0.0000000 0.3144099), wk = 0.0033113
k( 140) = ( 0.0000000 0.0000000 0.3144099), wk = 0.0033113
k( 141) = ( 0.0121951 0.0070409 0.3144099), wk = 0.0033113
k( 142) = ( 0.0243902 0.0140817 0.3144099), wk = 0.0033113
k( 143) = ( 0.0365854 0.0211226 0.3144099), wk = 0.0033113
k( 144) = ( 0.0487805 0.0281634 0.3144099), wk = 0.0033113
k( 145) = ( 0.0609756 0.0352043 0.3144099), wk = 0.0033113
k( 146) = ( 0.0731707 0.0422451 0.3144099), wk = 0.0033113
k( 147) = ( 0.0853658 0.0492860 0.3144099), wk = 0.0033113
k( 148) = ( 0.0975610 0.0563269 0.3144099), wk = 0.0033113
k( 149) = ( 0.1097561 0.0633677 0.3144099), wk = 0.0033113
k( 150) = ( 0.1219512 0.0704086 0.3144099), wk = 0.0033113
k( 151) = ( 0.1341463 0.0774494 0.3144099), wk = 0.0033113
k( 152) = ( 0.1463415 0.0844903 0.3144099), wk = 0.0033113
k( 153) = ( 0.1585366 0.0915311 0.3144099), wk = 0.0033113
k( 154) = ( 0.1707317 0.0985720 0.3144099), wk = 0.0033113
k( 155) = ( 0.1829268 0.1056129 0.3144099), wk = 0.0033113
k( 156) = ( 0.1951219 0.1126537 0.3144099), wk = 0.0033113
k( 157) = ( 0.2073171 0.1196946 0.3144099), wk = 0.0033113
k( 158) = ( 0.2195122 0.1267354 0.3144099), wk = 0.0033113
k( 159) = ( 0.2317073 0.1337763 0.3144099), wk = 0.0033113
k( 160) = ( 0.2439024 0.1408171 0.3144099), wk = 0.0033113
k( 161) = ( 0.2560976 0.1478580 0.3144099), wk = 0.0033113
k( 162) = ( 0.2682927 0.1548989 0.3144099), wk = 0.0033113
k( 163) = ( 0.2804878 0.1619397 0.3144099), wk = 0.0033113
k( 164) = ( 0.2926829 0.1689806 0.3144099), wk = 0.0033113
k( 165) = ( 0.3048781 0.1760214 0.3144099), wk = 0.0033113
k( 166) = ( 0.3170732 0.1830623 0.3144099), wk = 0.0033113
k( 167) = ( 0.3292683 0.1901031 0.3144099), wk = 0.0033113
k( 168) = ( 0.3414634 0.1971440 0.3144099), wk = 0.0033113
k( 169) = ( 0.3536585 0.2041849 0.3144099), wk = 0.0033113
k( 170) = ( 0.3658537 0.2112257 0.3144099), wk = 0.0033113
k( 171) = ( 0.3780488 0.2182666 0.3144099), wk = 0.0033113
k( 172) = ( 0.3902439 0.2253074 0.3144099), wk = 0.0033113
k( 173) = ( 0.4024390 0.2323483 0.3144099), wk = 0.0033113
k( 174) = ( 0.4146341 0.2393891 0.3144099), wk = 0.0033113
k( 175) = ( 0.4268293 0.2464300 0.3144099), wk = 0.0033113
k( 176) = ( 0.4390244 0.2534708 0.3144099), wk = 0.0033113
k( 177) = ( 0.4512195 0.2605117 0.3144099), wk = 0.0033113
k( 178) = ( 0.4634146 0.2675526 0.3144099), wk = 0.0033113
k( 179) = ( 0.4756098 0.2745934 0.3144099), wk = 0.0033113
k( 180) = ( 0.4878049 0.2816343 0.3144099), wk = 0.0033113
k( 181) = ( 0.5000000 0.2886751 0.3144099), wk = 0.0033113
k( 182) = ( 0.5000000 0.2886751 0.3144099), wk = 0.0033113
k( 183) = ( 0.4930556 0.3007033 0.3144099), wk = 0.0033113
k( 184) = ( 0.4861111 0.3127314 0.3144099), wk = 0.0033113
k( 185) = ( 0.4791667 0.3247595 0.3144099), wk = 0.0033113
k( 186) = ( 0.4722222 0.3367877 0.3144099), wk = 0.0033113
k( 187) = ( 0.4652778 0.3488158 0.3144099), wk = 0.0033113
k( 188) = ( 0.4583333 0.3608439 0.3144099), wk = 0.0033113
k( 189) = ( 0.4513889 0.3728720 0.3144099), wk = 0.0033113
k( 190) = ( 0.4444444 0.3849002 0.3144099), wk = 0.0033113
k( 191) = ( 0.4375000 0.3969283 0.3144099), wk = 0.0033113
k( 192) = ( 0.4305556 0.4089564 0.3144099), wk = 0.0033113
k( 193) = ( 0.4236111 0.4209846 0.3144099), wk = 0.0033113
k( 194) = ( 0.4166667 0.4330127 0.3144099), wk = 0.0033113
k( 195) = ( 0.4097222 0.4450408 0.3144099), wk = 0.0033113
k( 196) = ( 0.4027778 0.4570690 0.3144099), wk = 0.0033113
k( 197) = ( 0.3958333 0.4690971 0.3144099), wk = 0.0033113
k( 198) = ( 0.3888889 0.4811252 0.3144099), wk = 0.0033113
k( 199) = ( 0.3819444 0.4931534 0.3144099), wk = 0.0033113
k( 200) = ( 0.3750000 0.5051815 0.3144099), wk = 0.0033113
k( 201) = ( 0.3680556 0.5172096 0.3144099), wk = 0.0033113
k( 202) = ( 0.3611111 0.5292377 0.3144099), wk = 0.0033113
k( 203) = ( 0.3541667 0.5412659 0.3144099), wk = 0.0033113
k( 204) = ( 0.3472222 0.5532940 0.3144099), wk = 0.0033113
k( 205) = ( 0.3402778 0.5653221 0.3144099), wk = 0.0033113
k( 206) = ( 0.3333333 0.5773503 0.3144099), wk = 0.0033113
k( 207) = ( 0.3333333 0.5773503 0.3144099), wk = 0.0033113
k( 208) = ( 0.3262411 0.5650662 0.3144099), wk = 0.0033113
k( 209) = ( 0.3191489 0.5527822 0.3144099), wk = 0.0033113
k( 210) = ( 0.3120567 0.5404981 0.3144099), wk = 0.0033113
k( 211) = ( 0.3049645 0.5282141 0.3144099), wk = 0.0033113
k( 212) = ( 0.2978723 0.5159300 0.3144099), wk = 0.0033113
k( 213) = ( 0.2907801 0.5036460 0.3144099), wk = 0.0033113
k( 214) = ( 0.2836879 0.4913619 0.3144099), wk = 0.0033113
k( 215) = ( 0.2765957 0.4790779 0.3144099), wk = 0.0033113
k( 216) = ( 0.2695035 0.4667938 0.3144099), wk = 0.0033113
k( 217) = ( 0.2624113 0.4545098 0.3144099), wk = 0.0033113
k( 218) = ( 0.2553191 0.4422257 0.3144099), wk = 0.0033113
k( 219) = ( 0.2482270 0.4299417 0.3144099), wk = 0.0033113
k( 220) = ( 0.2411348 0.4176576 0.3144099), wk = 0.0033113
k( 221) = ( 0.2340425 0.4053736 0.3144099), wk = 0.0033113
k( 222) = ( 0.2269503 0.3930895 0.3144099), wk = 0.0033113
k( 223) = ( 0.2198582 0.3808055 0.3144099), wk = 0.0033113
k( 224) = ( 0.2127660 0.3685215 0.3144099), wk = 0.0033113
k( 225) = ( 0.2056738 0.3562374 0.3144099), wk = 0.0033113
k( 226) = ( 0.1985816 0.3439534 0.3144099), wk = 0.0033113
k( 227) = ( 0.1914894 0.3316693 0.3144099), wk = 0.0033113
k( 228) = ( 0.1843972 0.3193852 0.3144099), wk = 0.0033113
k( 229) = ( 0.1773050 0.3071012 0.3144099), wk = 0.0033113
k( 230) = ( 0.1702128 0.2948172 0.3144099), wk = 0.0033113
k( 231) = ( 0.1631206 0.2825331 0.3144099), wk = 0.0033113
k( 232) = ( 0.1560284 0.2702491 0.3144099), wk = 0.0033113
k( 233) = ( 0.1489362 0.2579650 0.3144099), wk = 0.0033113
k( 234) = ( 0.1418440 0.2456810 0.3144099), wk = 0.0033113
k( 235) = ( 0.1347518 0.2333969 0.3144099), wk = 0.0033113
k( 236) = ( 0.1276596 0.2211129 0.3144099), wk = 0.0033113
k( 237) = ( 0.1205674 0.2088288 0.3144099), wk = 0.0033113
k( 238) = ( 0.1134752 0.1965448 0.3144099), wk = 0.0033113
k( 239) = ( 0.1063830 0.1842607 0.3144099), wk = 0.0033113
k( 240) = ( 0.0992908 0.1719767 0.3144099), wk = 0.0033113
k( 241) = ( 0.0921986 0.1596926 0.3144099), wk = 0.0033113
k( 242) = ( 0.0851064 0.1474086 0.3144099), wk = 0.0033113
k( 243) = ( 0.0780142 0.1351245 0.3144099), wk = 0.0033113
k( 244) = ( 0.0709220 0.1228405 0.3144099), wk = 0.0033113
k( 245) = ( 0.0638298 0.1105564 0.3144099), wk = 0.0033113
k( 246) = ( 0.0567376 0.0982724 0.3144099), wk = 0.0033113
k( 247) = ( 0.0496454 0.0859883 0.3144099), wk = 0.0033113
k( 248) = ( 0.0425532 0.0737043 0.3144099), wk = 0.0033113
k( 249) = ( 0.0354610 0.0614202 0.3144099), wk = 0.0033113
k( 250) = ( 0.0283688 0.0491362 0.3144099), wk = 0.0033113
k( 251) = ( 0.0212766 0.0368522 0.3144099), wk = 0.0033113
k( 252) = ( 0.0141844 0.0245681 0.3144099), wk = 0.0033113
k( 253) = ( 0.0070922 0.0122841 0.3144099), wk = 0.0033113
k( 254) = ( 0.0000000 0.0000000 0.3144099), wk = 0.0033113
k( 255) = ( 0.5000000 0.2886751 0.3144099), wk = 0.0033113
k( 256) = ( 0.5000000 0.2886751 0.3007399), wk = 0.0033113
k( 257) = ( 0.5000000 0.2886751 0.2870699), wk = 0.0033113
k( 258) = ( 0.5000000 0.2886751 0.2733999), wk = 0.0033113
k( 259) = ( 0.5000000 0.2886751 0.2597299), wk = 0.0033113
k( 260) = ( 0.5000000 0.2886751 0.2460599), wk = 0.0033113
k( 261) = ( 0.5000000 0.2886751 0.2323899), wk = 0.0033113
k( 262) = ( 0.5000000 0.2886751 0.2187199), wk = 0.0033113
k( 263) = ( 0.5000000 0.2886751 0.2050499), wk = 0.0033113
k( 264) = ( 0.5000000 0.2886751 0.1913799), wk = 0.0033113
k( 265) = ( 0.5000000 0.2886751 0.1777099), wk = 0.0033113
k( 266) = ( 0.5000000 0.2886751 0.1640399), wk = 0.0033113
k( 267) = ( 0.5000000 0.2886751 0.1503699), wk = 0.0033113
k( 268) = ( 0.5000000 0.2886751 0.1366999), wk = 0.0033113
k( 269) = ( 0.5000000 0.2886751 0.1230299), wk = 0.0033113
k( 270) = ( 0.5000000 0.2886751 0.1093600), wk = 0.0033113
k( 271) = ( 0.5000000 0.2886751 0.0956900), wk = 0.0033113
k( 272) = ( 0.5000000 0.2886751 0.0820200), wk = 0.0033113
k( 273) = ( 0.5000000 0.2886751 0.0683500), wk = 0.0033113
k( 274) = ( 0.5000000 0.2886751 0.0546800), wk = 0.0033113
k( 275) = ( 0.5000000 0.2886751 0.0410100), wk = 0.0033113
k( 276) = ( 0.5000000 0.2886751 0.0273400), wk = 0.0033113
k( 277) = ( 0.5000000 0.2886751 0.0136700), wk = 0.0033113
k( 278) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0033113
k( 279) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0033113
k( 280) = ( 0.3333333 0.5773503 0.0136700), wk = 0.0033113
k( 281) = ( 0.3333333 0.5773503 0.0273400), wk = 0.0033113
k( 282) = ( 0.3333333 0.5773503 0.0410100), wk = 0.0033113
k( 283) = ( 0.3333333 0.5773503 0.0546800), wk = 0.0033113
k( 284) = ( 0.3333333 0.5773503 0.0683500), wk = 0.0033113
k( 285) = ( 0.3333333 0.5773503 0.0820200), wk = 0.0033113
k( 286) = ( 0.3333333 0.5773503 0.0956900), wk = 0.0033113
k( 287) = ( 0.3333333 0.5773503 0.1093600), wk = 0.0033113
k( 288) = ( 0.3333333 0.5773503 0.1230299), wk = 0.0033113
k( 289) = ( 0.3333333 0.5773503 0.1366999), wk = 0.0033113
k( 290) = ( 0.3333333 0.5773503 0.1503699), wk = 0.0033113
k( 291) = ( 0.3333333 0.5773503 0.1640399), wk = 0.0033113
k( 292) = ( 0.3333333 0.5773503 0.1777099), wk = 0.0033113
k( 293) = ( 0.3333333 0.5773503 0.1913799), wk = 0.0033113
k( 294) = ( 0.3333333 0.5773503 0.2050499), wk = 0.0033113
k( 295) = ( 0.3333333 0.5773503 0.2187199), wk = 0.0033113
k( 296) = ( 0.3333333 0.5773503 0.2323899), wk = 0.0033113
k( 297) = ( 0.3333333 0.5773503 0.2460599), wk = 0.0033113
k( 298) = ( 0.3333333 0.5773503 0.2597299), wk = 0.0033113
k( 299) = ( 0.3333333 0.5773503 0.2733999), wk = 0.0033113
k( 300) = ( 0.3333333 0.5773503 0.2870699), wk = 0.0033113
k( 301) = ( 0.3333333 0.5773503 0.3007399), wk = 0.0033113
k( 302) = ( 0.3333333 0.5773503 0.3144099), wk = 0.0033113
cryst. coord.
k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033113
k( 2) = ( 0.0121951 0.0000000 0.0000000), wk = 0.0033113
k( 3) = ( 0.0243902 0.0000000 0.0000000), wk = 0.0033113
k( 4) = ( 0.0365854 0.0000000 0.0000000), wk = 0.0033113
k( 5) = ( 0.0487805 0.0000000 0.0000000), wk = 0.0033113
k( 6) = ( 0.0609756 -0.0000000 0.0000000), wk = 0.0033113
k( 7) = ( 0.0731707 0.0000000 0.0000000), wk = 0.0033113
k( 8) = ( 0.0853658 -0.0000000 0.0000000), wk = 0.0033113
k( 9) = ( 0.0975610 0.0000000 0.0000000), wk = 0.0033113
k( 10) = ( 0.1097561 0.0000000 0.0000000), wk = 0.0033113
k( 11) = ( 0.1219512 -0.0000000 0.0000000), wk = 0.0033113
k( 12) = ( 0.1341463 0.0000000 0.0000000), wk = 0.0033113
k( 13) = ( 0.1463415 0.0000000 0.0000000), wk = 0.0033113
k( 14) = ( 0.1585366 -0.0000000 -0.0000000), wk = 0.0033113
k( 15) = ( 0.1707317 -0.0000000 0.0000000), wk = 0.0033113
k( 16) = ( 0.1829268 -0.0000000 0.0000000), wk = 0.0033113
k( 17) = ( 0.1951219 0.0000000 0.0000000), wk = 0.0033113
k( 18) = ( 0.2073171 -0.0000000 0.0000000), wk = 0.0033113
k( 19) = ( 0.2195122 0.0000000 0.0000000), wk = 0.0033113
k( 20) = ( 0.2317073 -0.0000000 0.0000000), wk = 0.0033113
k( 21) = ( 0.2439024 -0.0000000 0.0000000), wk = 0.0033113
k( 22) = ( 0.2560976 0.0000000 0.0000000), wk = 0.0033113
k( 23) = ( 0.2682927 0.0000000 0.0000000), wk = 0.0033113
k( 24) = ( 0.2804878 0.0000000 0.0000000), wk = 0.0033113
k( 25) = ( 0.2926829 -0.0000000 0.0000000), wk = 0.0033113
k( 26) = ( 0.3048781 0.0000000 0.0000000), wk = 0.0033113
k( 27) = ( 0.3170732 0.0000000 0.0000000), wk = 0.0033113
k( 28) = ( 0.3292683 -0.0000000 -0.0000000), wk = 0.0033113
k( 29) = ( 0.3414634 -0.0000000 0.0000000), wk = 0.0033113
k( 30) = ( 0.3536585 -0.0000000 0.0000000), wk = 0.0033113
k( 31) = ( 0.3658537 -0.0000000 0.0000000), wk = 0.0033113
k( 32) = ( 0.3780488 0.0000000 -0.0000000), wk = 0.0033113
k( 33) = ( 0.3902439 0.0000000 0.0000000), wk = 0.0033113
k( 34) = ( 0.4024390 0.0000000 0.0000000), wk = 0.0033113
k( 35) = ( 0.4146341 0.0000000 0.0000000), wk = 0.0033113
k( 36) = ( 0.4268293 -0.0000000 0.0000000), wk = 0.0033113
k( 37) = ( 0.4390244 0.0000000 0.0000000), wk = 0.0033113
k( 38) = ( 0.4512195 -0.0000000 0.0000000), wk = 0.0033113
k( 39) = ( 0.4634146 -0.0000000 -0.0000000), wk = 0.0033113
k( 40) = ( 0.4756098 -0.0000000 -0.0000000), wk = 0.0033113
k( 41) = ( 0.4878049 -0.0000000 0.0000000), wk = 0.0033113
k( 42) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0033113
k( 43) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0033113
k( 44) = ( 0.4930556 0.0138889 0.0000000), wk = 0.0033113
k( 45) = ( 0.4861111 0.0277778 0.0000000), wk = 0.0033113
k( 46) = ( 0.4791667 0.0416667 0.0000000), wk = 0.0033113
k( 47) = ( 0.4722222 0.0555556 0.0000000), wk = 0.0033113
k( 48) = ( 0.4652778 0.0694444 0.0000000), wk = 0.0033113
k( 49) = ( 0.4583333 0.0833333 0.0000000), wk = 0.0033113
k( 50) = ( 0.4513889 0.0972222 0.0000000), wk = 0.0033113
k( 51) = ( 0.4444444 0.1111111 0.0000000), wk = 0.0033113
k( 52) = ( 0.4375000 0.1250000 0.0000000), wk = 0.0033113
k( 53) = ( 0.4305556 0.1388889 0.0000000), wk = 0.0033113
k( 54) = ( 0.4236111 0.1527778 0.0000000), wk = 0.0033113
k( 55) = ( 0.4166667 0.1666667 0.0000000), wk = 0.0033113
k( 56) = ( 0.4097222 0.1805556 0.0000000), wk = 0.0033113
k( 57) = ( 0.4027778 0.1944444 0.0000000), wk = 0.0033113
k( 58) = ( 0.3958333 0.2083333 0.0000000), wk = 0.0033113
k( 59) = ( 0.3888889 0.2222222 0.0000000), wk = 0.0033113
k( 60) = ( 0.3819444 0.2361111 -0.0000000), wk = 0.0033113
k( 61) = ( 0.3750000 0.2500000 0.0000000), wk = 0.0033113
k( 62) = ( 0.3680556 0.2638889 0.0000000), wk = 0.0033113
k( 63) = ( 0.3611111 0.2777778 0.0000000), wk = 0.0033113
k( 64) = ( 0.3541667 0.2916667 0.0000000), wk = 0.0033113
k( 65) = ( 0.3472222 0.3055556 0.0000000), wk = 0.0033113
k( 66) = ( 0.3402778 0.3194444 0.0000000), wk = 0.0033113
k( 67) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0033113
k( 68) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0033113
k( 69) = ( 0.3262411 0.3262411 -0.0000000), wk = 0.0033113
k( 70) = ( 0.3191489 0.3191489 -0.0000000), wk = 0.0033113
k( 71) = ( 0.3120567 0.3120567 -0.0000000), wk = 0.0033113
k( 72) = ( 0.3049645 0.3049645 0.0000000), wk = 0.0033113
k( 73) = ( 0.2978723 0.2978723 -0.0000000), wk = 0.0033113
k( 74) = ( 0.2907801 0.2907801 0.0000000), wk = 0.0033113
k( 75) = ( 0.2836879 0.2836879 -0.0000000), wk = 0.0033113
k( 76) = ( 0.2765957 0.2765957 0.0000000), wk = 0.0033113
k( 77) = ( 0.2695035 0.2695035 -0.0000000), wk = 0.0033113
k( 78) = ( 0.2624113 0.2624113 0.0000000), wk = 0.0033113
k( 79) = ( 0.2553191 0.2553191 -0.0000000), wk = 0.0033113
k( 80) = ( 0.2482270 0.2482270 0.0000000), wk = 0.0033113
k( 81) = ( 0.2411348 0.2411347 0.0000000), wk = 0.0033113
k( 82) = ( 0.2340425 0.2340425 0.0000000), wk = 0.0033113
k( 83) = ( 0.2269503 0.2269503 0.0000000), wk = 0.0033113
k( 84) = ( 0.2198582 0.2198582 0.0000000), wk = 0.0033113
k( 85) = ( 0.2127660 0.2127660 0.0000000), wk = 0.0033113
k( 86) = ( 0.2056738 0.2056738 0.0000000), wk = 0.0033113
k( 87) = ( 0.1985816 0.1985816 -0.0000000), wk = 0.0033113
k( 88) = ( 0.1914894 0.1914894 0.0000000), wk = 0.0033113
k( 89) = ( 0.1843972 0.1843972 0.0000000), wk = 0.0033113
k( 90) = ( 0.1773050 0.1773050 0.0000000), wk = 0.0033113
k( 91) = ( 0.1702128 0.1702128 -0.0000000), wk = 0.0033113
k( 92) = ( 0.1631206 0.1631206 -0.0000000), wk = 0.0033113
k( 93) = ( 0.1560284 0.1560284 -0.0000000), wk = 0.0033113
k( 94) = ( 0.1489362 0.1489362 -0.0000000), wk = 0.0033113
k( 95) = ( 0.1418440 0.1418440 -0.0000000), wk = 0.0033113
k( 96) = ( 0.1347518 0.1347518 0.0000000), wk = 0.0033113
k( 97) = ( 0.1276596 0.1276596 0.0000000), wk = 0.0033113
k( 98) = ( 0.1205674 0.1205674 0.0000000), wk = 0.0033113
k( 99) = ( 0.1134752 0.1134752 0.0000000), wk = 0.0033113
k( 100) = ( 0.1063830 0.1063830 0.0000000), wk = 0.0033113
k( 101) = ( 0.0992908 0.0992908 -0.0000000), wk = 0.0033113
k( 102) = ( 0.0921986 0.0921986 0.0000000), wk = 0.0033113
k( 103) = ( 0.0851064 0.0851064 0.0000000), wk = 0.0033113
k( 104) = ( 0.0780142 0.0780142 0.0000000), wk = 0.0033113
k( 105) = ( 0.0709220 0.0709220 0.0000000), wk = 0.0033113
k( 106) = ( 0.0638298 0.0638298 0.0000000), wk = 0.0033113
k( 107) = ( 0.0567376 0.0567376 0.0000000), wk = 0.0033113
k( 108) = ( 0.0496454 0.0496454 -0.0000000), wk = 0.0033113
k( 109) = ( 0.0425532 0.0425532 0.0000000), wk = 0.0033113
k( 110) = ( 0.0354610 0.0354610 0.0000000), wk = 0.0033113
k( 111) = ( 0.0283688 0.0283688 0.0000000), wk = 0.0033113
k( 112) = ( 0.0212766 0.0212766 0.0000000), wk = 0.0033113
k( 113) = ( 0.0141844 0.0141844 0.0000000), wk = 0.0033113
k( 114) = ( 0.0070922 0.0070922 0.0000000), wk = 0.0033113
k( 115) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033113
k( 116) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033113
k( 117) = ( 0.0000000 0.0000000 0.0217391), wk = 0.0033113
k( 118) = ( 0.0000000 0.0000000 0.0434783), wk = 0.0033113
k( 119) = ( 0.0000000 0.0000000 0.0652174), wk = 0.0033113
k( 120) = ( 0.0000000 0.0000000 0.0869565), wk = 0.0033113
k( 121) = ( 0.0000000 0.0000000 0.1086957), wk = 0.0033113
k( 122) = ( 0.0000000 0.0000000 0.1304348), wk = 0.0033113
k( 123) = ( 0.0000000 0.0000000 0.1521739), wk = 0.0033113
k( 124) = ( 0.0000000 0.0000000 0.1739130), wk = 0.0033113
k( 125) = ( 0.0000000 0.0000000 0.1956522), wk = 0.0033113
k( 126) = ( 0.0000000 0.0000000 0.2173913), wk = 0.0033113
k( 127) = ( 0.0000000 0.0000000 0.2391304), wk = 0.0033113
k( 128) = ( 0.0000000 0.0000000 0.2608696), wk = 0.0033113
k( 129) = ( 0.0000000 0.0000000 0.2826087), wk = 0.0033113
k( 130) = ( 0.0000000 0.0000000 0.3043478), wk = 0.0033113
k( 131) = ( 0.0000000 0.0000000 0.3260870), wk = 0.0033113
k( 132) = ( 0.0000000 0.0000000 0.3478261), wk = 0.0033113
k( 133) = ( 0.0000000 0.0000000 0.3695652), wk = 0.0033113
k( 134) = ( 0.0000000 0.0000000 0.3913044), wk = 0.0033113
k( 135) = ( 0.0000000 0.0000000 0.4130435), wk = 0.0033113
k( 136) = ( 0.0000000 0.0000000 0.4347826), wk = 0.0033113
k( 137) = ( 0.0000000 0.0000000 0.4565217), wk = 0.0033113
k( 138) = ( 0.0000000 0.0000000 0.4782609), wk = 0.0033113
k( 139) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033113
k( 140) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033113
k( 141) = ( 0.0121951 0.0000000 0.5000000), wk = 0.0033113
k( 142) = ( 0.0243902 0.0000000 0.5000000), wk = 0.0033113
k( 143) = ( 0.0365854 0.0000000 0.5000000), wk = 0.0033113
k( 144) = ( 0.0487805 0.0000000 0.5000000), wk = 0.0033113
k( 145) = ( 0.0609756 -0.0000000 0.5000000), wk = 0.0033113
k( 146) = ( 0.0731707 0.0000000 0.5000000), wk = 0.0033113
k( 147) = ( 0.0853658 -0.0000000 0.5000000), wk = 0.0033113
k( 148) = ( 0.0975610 0.0000000 0.5000000), wk = 0.0033113
k( 149) = ( 0.1097561 0.0000000 0.5000000), wk = 0.0033113
k( 150) = ( 0.1219512 -0.0000000 0.5000000), wk = 0.0033113
k( 151) = ( 0.1341463 0.0000000 0.5000000), wk = 0.0033113
k( 152) = ( 0.1463415 0.0000000 0.5000000), wk = 0.0033113
k( 153) = ( 0.1585366 -0.0000000 0.5000000), wk = 0.0033113
k( 154) = ( 0.1707317 -0.0000000 0.5000000), wk = 0.0033113
k( 155) = ( 0.1829268 -0.0000000 0.5000000), wk = 0.0033113
k( 156) = ( 0.1951219 0.0000000 0.5000000), wk = 0.0033113
k( 157) = ( 0.2073171 -0.0000000 0.5000000), wk = 0.0033113
k( 158) = ( 0.2195122 0.0000000 0.5000000), wk = 0.0033113
k( 159) = ( 0.2317073 -0.0000000 0.5000000), wk = 0.0033113
k( 160) = ( 0.2439024 -0.0000000 0.5000000), wk = 0.0033113
k( 161) = ( 0.2560976 0.0000000 0.5000000), wk = 0.0033113
k( 162) = ( 0.2682927 0.0000000 0.5000000), wk = 0.0033113
k( 163) = ( 0.2804878 0.0000000 0.5000000), wk = 0.0033113
k( 164) = ( 0.2926829 -0.0000000 0.5000000), wk = 0.0033113
k( 165) = ( 0.3048781 0.0000000 0.5000000), wk = 0.0033113
k( 166) = ( 0.3170732 0.0000000 0.5000000), wk = 0.0033113
k( 167) = ( 0.3292683 -0.0000000 0.5000000), wk = 0.0033113
k( 168) = ( 0.3414634 -0.0000000 0.5000000), wk = 0.0033113
k( 169) = ( 0.3536585 -0.0000000 0.5000000), wk = 0.0033113
k( 170) = ( 0.3658537 -0.0000000 0.5000000), wk = 0.0033113
k( 171) = ( 0.3780488 0.0000000 0.5000000), wk = 0.0033113
k( 172) = ( 0.3902439 0.0000000 0.5000000), wk = 0.0033113
k( 173) = ( 0.4024390 0.0000000 0.5000000), wk = 0.0033113
k( 174) = ( 0.4146341 0.0000000 0.5000000), wk = 0.0033113
k( 175) = ( 0.4268293 -0.0000000 0.5000000), wk = 0.0033113
k( 176) = ( 0.4390244 0.0000000 0.5000000), wk = 0.0033113
k( 177) = ( 0.4512195 -0.0000000 0.5000000), wk = 0.0033113
k( 178) = ( 0.4634146 -0.0000000 0.5000000), wk = 0.0033113
k( 179) = ( 0.4756098 -0.0000000 0.5000000), wk = 0.0033113
k( 180) = ( 0.4878049 -0.0000000 0.5000000), wk = 0.0033113
k( 181) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0033113
k( 182) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0033113
k( 183) = ( 0.4930556 0.0138889 0.5000000), wk = 0.0033113
k( 184) = ( 0.4861111 0.0277778 0.5000000), wk = 0.0033113
k( 185) = ( 0.4791667 0.0416667 0.5000000), wk = 0.0033113
k( 186) = ( 0.4722222 0.0555556 0.5000000), wk = 0.0033113
k( 187) = ( 0.4652778 0.0694444 0.5000000), wk = 0.0033113
k( 188) = ( 0.4583333 0.0833333 0.5000000), wk = 0.0033113
k( 189) = ( 0.4513889 0.0972222 0.5000000), wk = 0.0033113
k( 190) = ( 0.4444444 0.1111111 0.5000000), wk = 0.0033113
k( 191) = ( 0.4375000 0.1250000 0.5000000), wk = 0.0033113
k( 192) = ( 0.4305556 0.1388889 0.5000000), wk = 0.0033113
k( 193) = ( 0.4236111 0.1527778 0.5000000), wk = 0.0033113
k( 194) = ( 0.4166667 0.1666667 0.5000000), wk = 0.0033113
k( 195) = ( 0.4097222 0.1805556 0.5000000), wk = 0.0033113
k( 196) = ( 0.4027778 0.1944444 0.5000000), wk = 0.0033113
k( 197) = ( 0.3958333 0.2083333 0.5000000), wk = 0.0033113
k( 198) = ( 0.3888889 0.2222222 0.5000000), wk = 0.0033113
k( 199) = ( 0.3819444 0.2361111 0.5000000), wk = 0.0033113
k( 200) = ( 0.3750000 0.2500000 0.5000000), wk = 0.0033113
k( 201) = ( 0.3680556 0.2638889 0.5000000), wk = 0.0033113
k( 202) = ( 0.3611111 0.2777778 0.5000000), wk = 0.0033113
k( 203) = ( 0.3541667 0.2916667 0.5000000), wk = 0.0033113
k( 204) = ( 0.3472222 0.3055556 0.5000000), wk = 0.0033113
k( 205) = ( 0.3402778 0.3194444 0.5000000), wk = 0.0033113
k( 206) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0033113
k( 207) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0033113
k( 208) = ( 0.3262411 0.3262411 0.5000000), wk = 0.0033113
k( 209) = ( 0.3191489 0.3191489 0.5000000), wk = 0.0033113
k( 210) = ( 0.3120567 0.3120567 0.5000000), wk = 0.0033113
k( 211) = ( 0.3049645 0.3049645 0.5000000), wk = 0.0033113
k( 212) = ( 0.2978723 0.2978723 0.5000000), wk = 0.0033113
k( 213) = ( 0.2907801 0.2907801 0.5000000), wk = 0.0033113
k( 214) = ( 0.2836879 0.2836879 0.5000000), wk = 0.0033113
k( 215) = ( 0.2765957 0.2765957 0.5000000), wk = 0.0033113
k( 216) = ( 0.2695035 0.2695035 0.5000000), wk = 0.0033113
k( 217) = ( 0.2624113 0.2624113 0.5000000), wk = 0.0033113
k( 218) = ( 0.2553191 0.2553191 0.5000000), wk = 0.0033113
k( 219) = ( 0.2482270 0.2482270 0.5000000), wk = 0.0033113
k( 220) = ( 0.2411348 0.2411347 0.5000000), wk = 0.0033113
k( 221) = ( 0.2340425 0.2340425 0.5000000), wk = 0.0033113
k( 222) = ( 0.2269503 0.2269503 0.5000000), wk = 0.0033113
k( 223) = ( 0.2198582 0.2198582 0.5000000), wk = 0.0033113
k( 224) = ( 0.2127660 0.2127660 0.5000000), wk = 0.0033113
k( 225) = ( 0.2056738 0.2056738 0.5000000), wk = 0.0033113
k( 226) = ( 0.1985816 0.1985816 0.5000000), wk = 0.0033113
k( 227) = ( 0.1914894 0.1914894 0.5000000), wk = 0.0033113
k( 228) = ( 0.1843972 0.1843972 0.5000000), wk = 0.0033113
k( 229) = ( 0.1773050 0.1773050 0.5000000), wk = 0.0033113
k( 230) = ( 0.1702128 0.1702128 0.5000000), wk = 0.0033113
k( 231) = ( 0.1631206 0.1631206 0.5000000), wk = 0.0033113
k( 232) = ( 0.1560284 0.1560284 0.5000000), wk = 0.0033113
k( 233) = ( 0.1489362 0.1489362 0.5000000), wk = 0.0033113
k( 234) = ( 0.1418440 0.1418440 0.5000000), wk = 0.0033113
k( 235) = ( 0.1347518 0.1347518 0.5000000), wk = 0.0033113
k( 236) = ( 0.1276596 0.1276596 0.5000000), wk = 0.0033113
k( 237) = ( 0.1205674 0.1205674 0.5000000), wk = 0.0033113
k( 238) = ( 0.1134752 0.1134752 0.5000000), wk = 0.0033113
k( 239) = ( 0.1063830 0.1063830 0.5000000), wk = 0.0033113
k( 240) = ( 0.0992908 0.0992908 0.5000000), wk = 0.0033113
k( 241) = ( 0.0921986 0.0921986 0.5000000), wk = 0.0033113
k( 242) = ( 0.0851064 0.0851064 0.5000000), wk = 0.0033113
k( 243) = ( 0.0780142 0.0780142 0.5000000), wk = 0.0033113
k( 244) = ( 0.0709220 0.0709220 0.5000000), wk = 0.0033113
k( 245) = ( 0.0638298 0.0638298 0.5000000), wk = 0.0033113
k( 246) = ( 0.0567376 0.0567376 0.5000000), wk = 0.0033113
k( 247) = ( 0.0496454 0.0496454 0.5000000), wk = 0.0033113
k( 248) = ( 0.0425532 0.0425532 0.5000000), wk = 0.0033113
k( 249) = ( 0.0354610 0.0354610 0.5000000), wk = 0.0033113
k( 250) = ( 0.0283688 0.0283688 0.5000000), wk = 0.0033113
k( 251) = ( 0.0212766 0.0212766 0.5000000), wk = 0.0033113
k( 252) = ( 0.0141844 0.0141844 0.5000000), wk = 0.0033113
k( 253) = ( 0.0070922 0.0070922 0.5000000), wk = 0.0033113
k( 254) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033113
k( 255) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0033113
k( 256) = ( 0.5000000 0.0000000 0.4782609), wk = 0.0033113
k( 257) = ( 0.5000000 0.0000000 0.4565217), wk = 0.0033113
k( 258) = ( 0.5000000 0.0000000 0.4347826), wk = 0.0033113
k( 259) = ( 0.5000000 0.0000000 0.4130435), wk = 0.0033113
k( 260) = ( 0.5000000 0.0000000 0.3913044), wk = 0.0033113
k( 261) = ( 0.5000000 0.0000000 0.3695652), wk = 0.0033113
k( 262) = ( 0.5000000 0.0000000 0.3478261), wk = 0.0033113
k( 263) = ( 0.5000000 0.0000000 0.3260870), wk = 0.0033113
k( 264) = ( 0.5000000 0.0000000 0.3043478), wk = 0.0033113
k( 265) = ( 0.5000000 0.0000000 0.2826087), wk = 0.0033113
k( 266) = ( 0.5000000 0.0000000 0.2608696), wk = 0.0033113
k( 267) = ( 0.5000000 0.0000000 0.2391304), wk = 0.0033113
k( 268) = ( 0.5000000 0.0000000 0.2173913), wk = 0.0033113
k( 269) = ( 0.5000000 0.0000000 0.1956522), wk = 0.0033113
k( 270) = ( 0.5000000 0.0000000 0.1739130), wk = 0.0033113
k( 271) = ( 0.5000000 0.0000000 0.1521739), wk = 0.0033113
k( 272) = ( 0.5000000 0.0000000 0.1304348), wk = 0.0033113
k( 273) = ( 0.5000000 0.0000000 0.1086957), wk = 0.0033113
k( 274) = ( 0.5000000 0.0000000 0.0869565), wk = 0.0033113
k( 275) = ( 0.5000000 0.0000000 0.0652174), wk = 0.0033113
k( 276) = ( 0.5000000 0.0000000 0.0434783), wk = 0.0033113
k( 277) = ( 0.5000000 0.0000000 0.0217391), wk = 0.0033113
k( 278) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0033113
k( 279) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0033113
k( 280) = ( 0.3333333 0.3333333 0.0217391), wk = 0.0033113
k( 281) = ( 0.3333333 0.3333333 0.0434783), wk = 0.0033113
k( 282) = ( 0.3333333 0.3333333 0.0652174), wk = 0.0033113
k( 283) = ( 0.3333333 0.3333333 0.0869565), wk = 0.0033113
k( 284) = ( 0.3333333 0.3333333 0.1086956), wk = 0.0033113
k( 285) = ( 0.3333333 0.3333333 0.1304348), wk = 0.0033113
k( 286) = ( 0.3333333 0.3333333 0.1521739), wk = 0.0033113
k( 287) = ( 0.3333333 0.3333333 0.1739130), wk = 0.0033113
k( 288) = ( 0.3333333 0.3333333 0.1956522), wk = 0.0033113
k( 289) = ( 0.3333333 0.3333333 0.2173913), wk = 0.0033113
k( 290) = ( 0.3333333 0.3333333 0.2391304), wk = 0.0033113
k( 291) = ( 0.3333333 0.3333333 0.2608696), wk = 0.0033113
k( 292) = ( 0.3333333 0.3333333 0.2826087), wk = 0.0033113
k( 293) = ( 0.3333333 0.3333333 0.3043478), wk = 0.0033113
k( 294) = ( 0.3333333 0.3333333 0.3260870), wk = 0.0033113
k( 295) = ( 0.3333333 0.3333333 0.3478261), wk = 0.0033113
k( 296) = ( 0.3333333 0.3333333 0.3695652), wk = 0.0033113
k( 297) = ( 0.3333333 0.3333333 0.3913044), wk = 0.0033113
k( 298) = ( 0.3333333 0.3333333 0.4130435), wk = 0.0033113
k( 299) = ( 0.3333333 0.3333333 0.4347826), wk = 0.0033113
k( 300) = ( 0.3333333 0.3333333 0.4565217), wk = 0.0033113
k( 301) = ( 0.3333333 0.3333333 0.4782609), wk = 0.0033113
k( 302) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0033113
Dense grid: 64991 G-vectors FFT dimensions: ( 45, 45, 72)
Smooth grid: 34113 G-vectors FFT dimensions: ( 40, 40, 60)
Largest allocated arrays est. size (Mb) dimensions
Kohn-Sham Wavefunctions 0.24 Mb ( 254, 62)
NL pseudopotentials 0.40 Mb ( 127, 204)
Each V/rho on FFT grid 0.06 Mb ( 4050)
Each G-vector array 0.01 Mb ( 1806)
G-vector shells 0.01 Mb ( 875)
Largest temporary arrays est. size (Mb) dimensions
Auxiliary wavefunctions 0.96 Mb ( 254, 248)
Each subspace H/S matrix 0.06 Mb ( 62, 62)
Each <psi_i|beta_j> matrix 0.39 Mb ( 204, 2, 62)
Check: negative/imaginary core charge= -0.000004 0.000000
The potential is recalculated from file :
./YAlZn.save/charge-density.dat
Starting wfc are 104 randomized atomic wfcs
Band Structure Calculation
Davidson diagonalization with overlap
Computing kpt #: 1
total cpu time spent up to now is 3.3 secs
Computing kpt #: 2
total cpu time spent up to now is 3.9 secs
Computing kpt #: 3
total cpu time spent up to now is 4.4 secs
Computing kpt #: 4
total cpu time spent up to now is 4.9 secs
Computing kpt #: 5
total cpu time spent up to now is 5.5 secs
Computing kpt #: 6
total cpu time spent up to now is 6.0 secs
Computing kpt #: 7
total cpu time spent up to now is 6.5 secs
Computing kpt #: 8
total cpu time spent up to now is 7.1 secs
Computing kpt #: 9
total cpu time spent up to now is 7.8 secs
Computing kpt #: 10
total cpu time spent up to now is 8.5 secs
Computing kpt #: 11
total cpu time spent up to now is 9.2 secs
Computing kpt #: 12
total cpu time spent up to now is 9.9 secs
Computing kpt #: 13
total cpu time spent up to now is 10.6 secs
Computing kpt #: 14
total cpu time spent up to now is 11.3 secs
Computing kpt #: 15
total cpu time spent up to now is 12.0 secs
Computing kpt #: 16
total cpu time spent up to now is 12.6 secs
Computing kpt #: 17
total cpu time spent up to now is 13.2 secs
Computing kpt #: 18
total cpu time spent up to now is 13.8 secs
Computing kpt #: 19
total cpu time spent up to now is 14.4 secs
Computing kpt #: 20
total cpu time spent up to now is 15.0 secs
Computing kpt #: 21
total cpu time spent up to now is 15.6 secs
Computing kpt #: 22
total cpu time spent up to now is 16.2 secs
Computing kpt #: 23
total cpu time spent up to now is 16.7 secs
Computing kpt #: 24
total cpu time spent up to now is 17.3 secs
Computing kpt #: 25
total cpu time spent up to now is 17.9 secs
Computing kpt #: 26
total cpu time spent up to now is 18.6 secs
Computing kpt #: 27
total cpu time spent up to now is 19.3 secs
Computing kpt #: 28
total cpu time spent up to now is 20.0 secs
Computing kpt #: 29
total cpu time spent up to now is 20.7 secs
Computing kpt #: 30
total cpu time spent up to now is 21.4 secs
Computing kpt #: 31
total cpu time spent up to now is 22.1 secs
Computing kpt #: 32
total cpu time spent up to now is 22.8 secs
Computing kpt #: 33
total cpu time spent up to now is 23.5 secs
Computing kpt #: 34
total cpu time spent up to now is 24.2 secs
Computing kpt #: 35
total cpu time spent up to now is 24.9 secs
Computing kpt #: 36
total cpu time spent up to now is 25.6 secs
Computing kpt #: 37
total cpu time spent up to now is 26.3 secs
Computing kpt #: 38
total cpu time spent up to now is 27.0 secs
Computing kpt #: 39
total cpu time spent up to now is 27.6 secs
Computing kpt #: 40
total cpu time spent up to now is 28.3 secs
Computing kpt #: 41
total cpu time spent up to now is 29.0 secs
Computing kpt #: 42
total cpu time spent up to now is 29.8 secs
Computing kpt #: 43
total cpu time spent up to now is 30.6 secs
Computing kpt #: 44
total cpu time spent up to now is 31.3 secs
Computing kpt #: 45
total cpu time spent up to now is 31.9 secs
Computing kpt #: 46
total cpu time spent up to now is 32.6 secs
Computing kpt #: 47
total cpu time spent up to now is 33.3 secs
Computing kpt #: 48
total cpu time spent up to now is 34.0 secs
Computing kpt #: 49
total cpu time spent up to now is 34.7 secs
Computing kpt #: 50
total cpu time spent up to now is 35.3 secs
Computing kpt #: 51
total cpu time spent up to now is 35.9 secs
Computing kpt #: 52
total cpu time spent up to now is 39.0 secs
Computing kpt #: 53
total cpu time spent up to now is 39.6 secs
Computing kpt #: 54
total cpu time spent up to now is 40.2 secs
Computing kpt #: 55
total cpu time spent up to now is 40.9 secs
Computing kpt #: 56
total cpu time spent up to now is 41.6 secs
Computing kpt #: 57
total cpu time spent up to now is 42.2 secs
Computing kpt #: 58
total cpu time spent up to now is 42.9 secs
Computing kpt #: 59
total cpu time spent up to now is 43.6 secs
Computing kpt #: 60
total cpu time spent up to now is 44.3 secs
Computing kpt #: 61
total cpu time spent up to now is 45.0 secs
Computing kpt #: 62
total cpu time spent up to now is 45.6 secs
Computing kpt #: 63
total cpu time spent up to now is 46.3 secs
Computing kpt #: 64
total cpu time spent up to now is 47.0 secs
Computing kpt #: 65
total cpu time spent up to now is 47.6 secs
Computing kpt #: 66
total cpu time spent up to now is 48.3 secs
Computing kpt #: 67
total cpu time spent up to now is 49.0 secs
Computing kpt #: 68
total cpu time spent up to now is 49.7 secs
Computing kpt #: 69
total cpu time spent up to now is 50.3 secs
Computing kpt #: 70
total cpu time spent up to now is 51.0 secs
Computing kpt #: 71
total cpu time spent up to now is 51.7 secs
Computing kpt #: 72
total cpu time spent up to now is 52.4 secs
Computing kpt #: 73
total cpu time spent up to now is 53.0 secs
Computing kpt #: 74
total cpu time spent up to now is 53.7 secs
Computing kpt #: 75
total cpu time spent up to now is 54.4 secs
Computing kpt #: 76
total cpu time spent up to now is 55.1 secs
Computing kpt #: 77
total cpu time spent up to now is 55.8 secs
Computing kpt #: 78
total cpu time spent up to now is 56.4 secs
Computing kpt #: 79
total cpu time spent up to now is 57.0 secs
Computing kpt #: 80
total cpu time spent up to now is 57.6 secs
Computing kpt #: 81
total cpu time spent up to now is 58.3 secs
Computing kpt #: 82
total cpu time spent up to now is 59.0 secs
Computing kpt #: 83
total cpu time spent up to now is 59.6 secs
Computing kpt #: 84
total cpu time spent up to now is 60.3 secs
Computing kpt #: 85
total cpu time spent up to now is 61.0 secs
Computing kpt #: 86
total cpu time spent up to now is 61.7 secs
Computing kpt #: 87
total cpu time spent up to now is 62.4 secs
Computing kpt #: 88
total cpu time spent up to now is 63.1 secs
Computing kpt #: 89
total cpu time spent up to now is 63.8 secs
Computing kpt #: 90
total cpu time spent up to now is 64.5 secs
Computing kpt #: 91
total cpu time spent up to now is 65.2 secs
Computing kpt #: 92
total cpu time spent up to now is 65.9 secs
Computing kpt #: 93
total cpu time spent up to now is 66.7 secs
Computing kpt #: 94
total cpu time spent up to now is 67.4 secs
Computing kpt #: 95
total cpu time spent up to now is 68.1 secs
Computing kpt #: 96
total cpu time spent up to now is 68.8 secs
Computing kpt #: 97
total cpu time spent up to now is 69.6 secs
Computing kpt #: 98
total cpu time spent up to now is 70.3 secs
Computing kpt #: 99
total cpu time spent up to now is 71.1 secs
Computing kpt #: 100
total cpu time spent up to now is 71.9 secs
Computing kpt #: 101
total cpu time spent up to now is 72.6 secs
Computing kpt #: 102
total cpu time spent up to now is 73.3 secs
Computing kpt #: 103
total cpu time spent up to now is 74.0 secs
Computing kpt #: 104
total cpu time spent up to now is 74.7 secs
Computing kpt #: 105
total cpu time spent up to now is 75.4 secs
Computing kpt #: 106
total cpu time spent up to now is 76.1 secs
Computing kpt #: 107
total cpu time spent up to now is 76.8 secs
Computing kpt #: 108
total cpu time spent up to now is 77.3 secs
Computing kpt #: 109
total cpu time spent up to now is 77.9 secs
Computing kpt #: 110
total cpu time spent up to now is 78.4 secs
Computing kpt #: 111
total cpu time spent up to now is 78.9 secs
Computing kpt #: 112
total cpu time spent up to now is 79.5 secs
Computing kpt #: 113
total cpu time spent up to now is 80.0 secs
Computing kpt #: 114
total cpu time spent up to now is 80.5 secs
Computing kpt #: 115
total cpu time spent up to now is 81.0 secs
Computing kpt #: 116
total cpu time spent up to now is 81.6 secs
Computing kpt #: 117
total cpu time spent up to now is 82.1 secs
Computing kpt #: 118
total cpu time spent up to now is 82.6 secs
Computing kpt #: 119
total cpu time spent up to now is 83.2 secs
Computing kpt #: 120
total cpu time spent up to now is 83.8 secs
Computing kpt #: 121
total cpu time spent up to now is 84.4 secs
Computing kpt #: 122
total cpu time spent up to now is 85.1 secs
Computing kpt #: 123
total cpu time spent up to now is 85.8 secs
Computing kpt #: 124
total cpu time spent up to now is 86.5 secs
Computing kpt #: 125
total cpu time spent up to now is 87.2 secs
Computing kpt #: 126
total cpu time spent up to now is 87.9 secs
Computing kpt #: 127
total cpu time spent up to now is 88.6 secs
Computing kpt #: 128
total cpu time spent up to now is 89.3 secs
Computing kpt #: 129
total cpu time spent up to now is 89.9 secs
Computing kpt #: 130
total cpu time spent up to now is 90.5 secs
Computing kpt #: 131
total cpu time spent up to now is 91.1 secs
Computing kpt #: 132
total cpu time spent up to now is 91.7 secs
Computing kpt #: 133
total cpu time spent up to now is 92.3 secs
Computing kpt #: 134
total cpu time spent up to now is 92.9 secs
Computing kpt #: 135
total cpu time spent up to now is 93.5 secs
Computing kpt #: 136
total cpu time spent up to now is 94.1 secs
Computing kpt #: 137
total cpu time spent up to now is 94.7 secs
Computing kpt #: 138
total cpu time spent up to now is 95.3 secs
Computing kpt #: 139
total cpu time spent up to now is 95.9 secs
Computing kpt #: 140
total cpu time spent up to now is 96.4 secs
Computing kpt #: 141
total cpu time spent up to now is 97.0 secs
Computing kpt #: 142
total cpu time spent up to now is 97.6 secs
Computing kpt #: 143
total cpu time spent up to now is 98.2 secs
Computing kpt #: 144
total cpu time spent up to now is 98.8 secs
Computing kpt #: 145
total cpu time spent up to now is 99.4 secs
Computing kpt #: 146
total cpu time spent up to now is 100.0 secs
Computing kpt #: 147
total cpu time spent up to now is 100.6 secs
Computing kpt #: 148
total cpu time spent up to now is 101.2 secs
Computing kpt #: 149
total cpu time spent up to now is 101.8 secs
Computing kpt #: 150
total cpu time spent up to now is 102.4 secs
Computing kpt #: 151
total cpu time spent up to now is 103.1 secs
Computing kpt #: 152
total cpu time spent up to now is 103.8 secs
Computing kpt #: 153
total cpu time spent up to now is 104.5 secs
Computing kpt #: 154
total cpu time spent up to now is 105.2 secs
Computing kpt #: 155
total cpu time spent up to now is 105.9 secs
Computing kpt #: 156
total cpu time spent up to now is 106.6 secs
Computing kpt #: 157
total cpu time spent up to now is 107.2 secs
Computing kpt #: 158
total cpu time spent up to now is 107.8 secs
Computing kpt #: 159
total cpu time spent up to now is 108.4 secs
Computing kpt #: 160
total cpu time spent up to now is 109.0 secs
Computing kpt #: 161
total cpu time spent up to now is 109.6 secs
Computing kpt #: 162
total cpu time spent up to now is 110.2 secs
Computing kpt #: 163
total cpu time spent up to now is 110.8 secs
Computing kpt #: 164
total cpu time spent up to now is 111.4 secs
Computing kpt #: 165
total cpu time spent up to now is 112.1 secs
Computing kpt #: 166
total cpu time spent up to now is 112.7 secs
Computing kpt #: 167
total cpu time spent up to now is 113.3 secs
Computing kpt #: 168
total cpu time spent up to now is 113.9 secs
Computing kpt #: 169
total cpu time spent up to now is 114.6 secs
Computing kpt #: 170
total cpu time spent up to now is 115.3 secs
Computing kpt #: 171
total cpu time spent up to now is 116.0 secs
Computing kpt #: 172
total cpu time spent up to now is 116.6 secs
Computing kpt #: 173
total cpu time spent up to now is 117.2 secs
Computing kpt #: 174
total cpu time spent up to now is 117.9 secs
Computing kpt #: 175
total cpu time spent up to now is 118.7 secs
Computing kpt #: 176
total cpu time spent up to now is 119.4 secs
Computing kpt #: 177
total cpu time spent up to now is 120.1 secs
Computing kpt #: 178
total cpu time spent up to now is 120.8 secs
Computing kpt #: 179
total cpu time spent up to now is 121.5 secs
Computing kpt #: 180
total cpu time spent up to now is 122.2 secs
Computing kpt #: 181
total cpu time spent up to now is 122.9 secs
Computing kpt #: 182
total cpu time spent up to now is 123.6 secs
Computing kpt #: 183
total cpu time spent up to now is 124.3 secs
Computing kpt #: 184
total cpu time spent up to now is 125.0 secs
Computing kpt #: 185
total cpu time spent up to now is 125.8 secs
Computing kpt #: 186
total cpu time spent up to now is 126.5 secs
Computing kpt #: 187
total cpu time spent up to now is 127.3 secs
Computing kpt #: 188
total cpu time spent up to now is 128.0 secs
Computing kpt #: 189
total cpu time spent up to now is 128.7 secs
Computing kpt #: 190
total cpu time spent up to now is 129.4 secs
Computing kpt #: 191
total cpu time spent up to now is 130.2 secs
Computing kpt #: 192
total cpu time spent up to now is 130.9 secs
Computing kpt #: 193
total cpu time spent up to now is 132.2 secs
Computing kpt #: 194
total cpu time spent up to now is 133.4 secs
Computing kpt #: 195
total cpu time spent up to now is 134.3 secs
Computing kpt #: 196
total cpu time spent up to now is 135.1 secs
Computing kpt #: 197
total cpu time spent up to now is 135.9 secs
Computing kpt #: 198
total cpu time spent up to now is 136.7 secs
Computing kpt #: 199
total cpu time spent up to now is 137.7 secs
Computing kpt #: 200
total cpu time spent up to now is 138.5 secs
Computing kpt #: 201
total cpu time spent up to now is 139.4 secs
Computing kpt #: 202
c_bands: 1 eigenvalues not converged
total cpu time spent up to now is 141.2 secs
Computing kpt #: 203
c_bands: 1 eigenvalues not converged
total cpu time spent up to now is 142.9 secs
Computing kpt #: 204
c_bands: 1 eigenvalues not converged
total cpu time spent up to now is 144.7 secs
Computing kpt #: 205
c_bands: 1 eigenvalues not converged
total cpu time spent up to now is 146.5 secs
Computing kpt #: 206
total cpu time spent up to now is 147.7 secs
Computing kpt #: 207
total cpu time spent up to now is 149.1 secs
Computing kpt #: 208
c_bands: 1 eigenvalues not converged
total cpu time spent up to now is 150.9 secs
Computing kpt #: 209
total cpu time spent up to now is 152.2 secs
Computing kpt #: 210
total cpu time spent up to now is 153.0 secs
Computing kpt #: 211
total cpu time spent up to now is 153.7 secs
Computing kpt #: 212
total cpu time spent up to now is 154.5 secs
Computing kpt #: 213
total cpu time spent up to now is 155.2 secs
Computing kpt #: 214
total cpu time spent up to now is 156.0 secs
Computing kpt #: 215
total cpu time spent up to now is 156.7 secs
Computing kpt #: 216
total cpu time spent up to now is 157.4 secs
Computing kpt #: 217
total cpu time spent up to now is 158.1 secs
Computing kpt #: 218
total cpu time spent up to now is 158.9 secs
Computing kpt #: 219
total cpu time spent up to now is 159.6 secs
Computing kpt #: 220
total cpu time spent up to now is 160.3 secs
Computing kpt #: 221
total cpu time spent up to now is 161.1 secs
Computing kpt #: 222
total cpu time spent up to now is 161.8 secs
Computing kpt #: 223
total cpu time spent up to now is 162.6 secs
Computing kpt #: 224
total cpu time spent up to now is 163.3 secs
Computing kpt #: 225
total cpu time spent up to now is 164.1 secs
Computing kpt #: 226
total cpu time spent up to now is 165.0 secs
Computing kpt #: 227
total cpu time spent up to now is 165.8 secs
Computing kpt #: 228
total cpu time spent up to now is 166.6 secs
Computing kpt #: 229
total cpu time spent up to now is 167.6 secs
Computing kpt #: 230
total cpu time spent up to now is 168.5 secs
Computing kpt #: 231
c_bands: 1 eigenvalues not converged
total cpu time spent up to now is 170.3 secs
Computing kpt #: 232
c_bands: 1 eigenvalues not converged
total cpu time spent up to now is 172.1 secs
Computing kpt #: 233
c_bands: 1 eigenvalues not converged
total cpu time spent up to now is 173.8 secs
Computing kpt #: 234
total cpu time spent up to now is 175.3 secs
Computing kpt #: 235
c_bands: 2 eigenvalues not converged
total cpu time spent up to now is 177.2 secs
Computing kpt #: 236
total cpu time spent up to now is 178.1 secs
Computing kpt #: 237
c_bands: 1 eigenvalues not converged
total cpu time spent up to now is 179.9 secs
Computing kpt #: 238
total cpu time spent up to now is 181.1 secs
Computing kpt #: 239
c_bands: 1 eigenvalues not converged
total cpu time spent up to now is 183.0 secs
Computing kpt #: 240
c_bands: 1 eigenvalues not converged
total cpu time spent up to now is 184.7 secs
Computing kpt #: 241
total cpu time spent up to now is 186.2 secs
Computing kpt #: 242
c_bands: 1 eigenvalues not converged
total cpu time spent up to now is 188.0 secs
Computing kpt #: 243
c_bands: 1 eigenvalues not converged
total cpu time spent up to now is 189.8 secs
Computing kpt #: 244
c_bands: 1 eigenvalues not converged
total cpu time spent up to now is 191.6 secs
Computing kpt #: 245
total cpu time spent up to now is 192.6 secs
Computing kpt #: 246
total cpu time spent up to now is 193.6 secs
Computing kpt #: 247
total cpu time spent up to now is 194.3 secs
Computing kpt #: 248
total cpu time spent up to now is 194.9 secs
Computing kpt #: 249
total cpu time spent up to now is 195.5 secs
Computing kpt #: 250
total cpu time spent up to now is 196.1 secs
Computing kpt #: 251
total cpu time spent up to now is 196.7 secs
Computing kpt #: 252
total cpu time spent up to now is 197.2 secs
Computing kpt #: 253
total cpu time spent up to now is 197.8 secs
Computing kpt #: 254
total cpu time spent up to now is 198.4 secs
Computing kpt #: 255
total cpu time spent up to now is 199.1 secs
Computing kpt #: 256
total cpu time spent up to now is 199.8 secs
Computing kpt #: 257
total cpu time spent up to now is 200.5 secs
Computing kpt #: 258
total cpu time spent up to now is 201.2 secs
Computing kpt #: 259
total cpu time spent up to now is 201.9 secs
Computing kpt #: 260
total cpu time spent up to now is 202.6 secs
Computing kpt #: 261
total cpu time spent up to now is 203.3 secs
Computing kpt #: 262
total cpu time spent up to now is 204.0 secs
Computing kpt #: 263
total cpu time spent up to now is 204.7 secs
Computing kpt #: 264
total cpu time spent up to now is 205.4 secs
Computing kpt #: 265
total cpu time spent up to now is 206.0 secs
Computing kpt #: 266
total cpu time spent up to now is 206.6 secs
Computing kpt #: 267
total cpu time spent up to now is 207.3 secs
Computing kpt #: 268
total cpu time spent up to now is 208.0 secs
Computing kpt #: 269
total cpu time spent up to now is 208.6 secs
Computing kpt #: 270
total cpu time spent up to now is 209.3 secs
Computing kpt #: 271
total cpu time spent up to now is 210.0 secs
Computing kpt #: 272
total cpu time spent up to now is 210.7 secs
Computing kpt #: 273
total cpu time spent up to now is 211.4 secs
Computing kpt #: 274
total cpu time spent up to now is 212.2 secs
Computing kpt #: 275
total cpu time spent up to now is 212.9 secs
Computing kpt #: 276
total cpu time spent up to now is 213.7 secs
Computing kpt #: 277
total cpu time spent up to now is 214.4 secs
Computing kpt #: 278
total cpu time spent up to now is 215.1 secs
Computing kpt #: 279
total cpu time spent up to now is 215.8 secs
Computing kpt #: 280
total cpu time spent up to now is 216.5 secs
Computing kpt #: 281
total cpu time spent up to now is 217.2 secs
Computing kpt #: 282
total cpu time spent up to now is 217.8 secs
Computing kpt #: 283
total cpu time spent up to now is 218.5 secs
Computing kpt #: 284
total cpu time spent up to now is 219.2 secs
Computing kpt #: 285
total cpu time spent up to now is 219.8 secs
Computing kpt #: 286
total cpu time spent up to now is 220.5 secs
Computing kpt #: 287
total cpu time spent up to now is 221.2 secs
Computing kpt #: 288
total cpu time spent up to now is 221.9 secs
Computing kpt #: 289
total cpu time spent up to now is 222.6 secs
Computing kpt #: 290
total cpu time spent up to now is 223.3 secs
Computing kpt #: 291
total cpu time spent up to now is 224.0 secs
Computing kpt #: 292
total cpu time spent up to now is 225.0 secs
Computing kpt #: 293
total cpu time spent up to now is 225.7 secs
Computing kpt #: 294
total cpu time spent up to now is 226.5 secs
Computing kpt #: 295
total cpu time spent up to now is 227.3 secs
Computing kpt #: 296
total cpu time spent up to now is 228.1 secs
Computing kpt #: 297
total cpu time spent up to now is 228.9 secs
Computing kpt #: 298
total cpu time spent up to now is 229.8 secs
Computing kpt #: 299
total cpu time spent up to now is 230.7 secs
Computing kpt #: 300
total cpu time spent up to now is 232.2 secs
Computing kpt #: 301
total cpu time spent up to now is 233.6 secs
Computing kpt #: 302
total cpu time spent up to now is 235.2 secs
ethr = 1.92E-08, avg # of iterations = 30.2
total cpu time spent up to now is 235.2 secs
End of band structure calculation
k = 0.0000 0.0000 0.0000 ( 4235 PWs) bands (ev):
-32.8859 -32.8859 -32.8616 -32.8616 -13.9259 -13.9259 -13.8464 -13.8464
-12.5617 -12.5617 -12.4650 -12.4650 -12.4224 -12.4224 -12.3319 -12.3319
1.2774 1.2774 2.1794 2.1794 2.1923 2.1923 2.2456 2.2456
2.3152 2.3152 2.5132 2.5132 2.5677 2.5677 2.5698 2.5698
2.6175 2.6175 2.6756 2.6756 2.6993 2.6993 3.9134 3.9134
5.7018 5.7018 8.4471 8.4471 8.4557 8.4557 9.5286 9.5286
9.7652 9.7652 9.7825 9.7825 10.9060 10.9060 11.0181 11.0181
11.0628 11.0628 11.2134 11.2134 11.2750 11.2750
k = 0.0122 0.0070-0.0000 ( 4227 PWs) bands (ev):
-32.8859 -32.8859 -32.8616 -32.8616 -13.9259 -13.9259 -13.8465 -13.8465
-12.5617 -12.5617 -12.4651 -12.4651 -12.4225 -12.4225 -12.3319 -12.3319
1.2791 1.2791 2.1781 2.1781 2.1938 2.1938 2.2456 2.2456
2.3152 2.3152 2.5132 2.5132 2.5677 2.5677 2.5700 2.5700
2.6176 2.6176 2.6757 2.6757 2.6992 2.6992 3.9139 3.9139
5.7039 5.7039 8.4398 8.4398 8.4534 8.4534 9.5280 9.5280
9.7578 9.7578 9.7747 9.7747 10.9179 10.9179 11.0145 11.0145
11.0601 11.0601 11.2180 11.2180 11.2797 11.2797
k = 0.0244 0.0141-0.0000 ( 4231 PWs) bands (ev):
-32.8859 -32.8859 -32.8616 -32.8616 -13.9259 -13.9259 -13.8466 -13.8466
-12.5617 -12.5617 -12.4653 -12.4653 -12.4226 -12.4226 -12.3319 -12.3319
1.2841 1.2841 2.1753 2.1753 2.1970 2.1970 2.2455 2.2455
2.3154 2.3154 2.5131 2.5131 2.5677 2.5677 2.5704 2.5704
2.6178 2.6178 2.6760 2.6760 2.6990 2.6990 3.9153 3.9153
5.7101 5.7101 8.4113 8.4113 8.4537 8.4537 9.5262 9.5262
9.7359 9.7359 9.7516 9.7516 10.9530 10.9530 10.9991 10.9991
11.0570 11.0570 11.2264 11.2264 11.2989 11.2989
k = 0.0366 0.0211-0.0000 ( 4235 PWs) bands (ev):
-32.8859 -32.8859 -32.8616 -32.8616 -13.9260 -13.9260 -13.8467 -13.8467
-12.5618 -12.5618 -12.4656 -12.4656 -12.4229 -12.4229 -12.3320 -12.3320
1.2924 1.2924 2.1720 2.1720 2.2010 2.2010 2.2455 2.2455
2.3158 2.3158 2.5128 2.5128 2.5677 2.5677 2.5712 2.5712
2.6182 2.6182 2.6763 2.6763 2.6985 2.6985 3.9176 3.9176
5.7205 5.7205 8.3638 8.3638 8.4560 8.4560 9.5231 9.5231
9.7007 9.7007 9.7144 9.7144 10.9670 10.9670 11.0095 11.0095
11.0599 11.0599 11.2312 11.2312 11.3388 11.3388
k = 0.0488 0.0282-0.0000 ( 4235 PWs) bands (ev):
-32.8859 -32.8859 -32.8616 -32.8616 -13.9261 -13.9261 -13.8470 -13.8470
-12.5618 -12.5618 -12.4661 -12.4661 -12.4232 -12.4232 -12.3321 -12.3321
1.3039 1.3039 2.1687 2.1687 2.2054 2.2054 2.2454 2.2454
2.3163 2.3163 2.5126 2.5126 2.5676 2.5676 2.5722 2.5722
2.6187 2.6187 2.6769 2.6769 2.6979 2.6979 3.9209 3.9209
5.7349 5.7349 8.3004 8.3004 8.4593 8.4593 9.5189 9.5189
9.6534 9.6534 9.6646 9.6646 10.9204 10.9204 11.0683 11.0683
11.0850 11.0850 11.2329 11.2329 11.3979 11.3979
k = 0.0610 0.0352-0.0000 ( 4245 PWs) bands (ev):
-32.8858 -32.8858 -32.8615 -32.8615 -13.9263 -13.9263 -13.8473 -13.8473
-12.5618 -12.5618 -12.4666 -12.4666 -12.4237 -12.4237 -12.3322 -12.3322
1.3188 1.3188 2.1654 2.1654 2.2099 2.2099 2.2453 2.2453
2.3170 2.3170 2.5122 2.5122 2.5675 2.5675 2.5736 2.5736
2.6193 2.6193 2.6776 2.6776 2.6972 2.6972 3.9252 3.9252
5.7534 5.7534 8.2237 8.2237 8.4636 8.4636 9.5134 9.5134
9.5945 9.5945 9.6052 9.6052 10.8629 10.8629 11.0810 11.0810
11.1758 11.1758 11.2348 11.2348 11.4718 11.4718
k = 0.0732 0.0422-0.0000 ( 4245 PWs) bands (ev):
-32.8858 -32.8858 -32.8615 -32.8615 -13.9264 -13.9264 -13.8476 -13.8476
-12.5619 -12.5619 -12.4673 -12.4673 -12.4242 -12.4242 -12.3323 -12.3323
1.3369 1.3369 2.1622 2.1622 2.2146 2.2146 2.2453 2.2453
2.3177 2.3177 2.5118 2.5118 2.5675 2.5675 2.5752 2.5752
2.6201 2.6201 2.6784 2.6784 2.6964 2.6964 3.9304 3.9304
5.7760 5.7760 8.1360 8.1360 8.4688 8.4688 9.5065 9.5065
9.5226 9.5226 9.5408 9.5408 10.7970 10.7970 11.0972 11.0972
11.2344 11.2344 11.2837 11.2837 11.5573 11.5573
k = 0.0854 0.0493-0.0000 ( 4245 PWs) bands (ev):
-32.8858 -32.8858 -32.8615 -32.8615 -13.9266 -13.9266 -13.8480 -13.8480
-12.5619 -12.5619 -12.4681 -12.4681 -12.4249 -12.4249 -12.3325 -12.3325
1.3582 1.3582 2.1593 2.1593 2.2193 2.2193 2.2452 2.2452
2.3187 2.3187 2.5114 2.5114 2.5674 2.5674 2.5771 2.5771
2.6209 2.6209 2.6793 2.6793 2.6955 2.6955 3.9365 3.9365
5.8026 5.8026 8.0395 8.0395 8.4749 8.4749 9.4392 9.4392
9.4730 9.4730 9.4983 9.4983 10.7248 10.7248 11.1167 11.1167
11.2410 11.2410 11.3974 11.3974 11.6521 11.6521
k = 0.0976 0.0563-0.0000 ( 4253 PWs) bands (ev):
-32.8857 -32.8857 -32.8614 -32.8614 -13.9269 -13.9269 -13.8485 -13.8485
-12.5620 -12.5620 -12.4690 -12.4690 -12.4256 -12.4256 -12.3327 -12.3327
1.3827 1.3827 2.1566 2.1566 2.2240 2.2240 2.2452 2.2452
2.3197 2.3197 2.5110 2.5110 2.5674 2.5674 2.5792 2.5792
2.6219 2.6219 2.6803 2.6803 2.6945 2.6945 3.9436 3.9436
5.8330 5.8330 7.9362 7.9362 8.4819 8.4819 9.3469 9.3469
9.4024 9.4024 9.4883 9.4883 10.6479 10.6479 11.1393 11.1393
11.2500 11.2500 11.5188 11.5188 11.7545 11.7545
k = 0.1098 0.0634-0.0000 ( 4247 PWs) bands (ev):
-32.8856 -32.8856 -32.8614 -32.8614 -13.9271 -13.9271 -13.8490 -13.8490
-12.5621 -12.5621 -12.4700 -12.4700 -12.4264 -12.4264 -12.3328 -12.3328
1.4103 1.4103 2.1541 2.1541 2.2286 2.2286 2.2454 2.2454
2.3210 2.3210 2.5106 2.5106 2.5674 2.5674 2.5816 2.5816
2.6230 2.6230 2.6814 2.6814 2.6936 2.6936 3.9517 3.9517
5.8673 5.8673 7.8275 7.8275 8.4897 8.4897 9.2471 9.2471
9.3300 9.3300 9.4765 9.4765 10.5678 10.5678 11.1650 11.1650
11.2625 11.2625 11.6431 11.6431 11.8630 11.8630
k = 0.1220 0.0704-0.0000 ( 4245 PWs) bands (ev):
-32.8856 -32.8856 -32.8613 -32.8613 -13.9274 -13.9274 -13.8496 -13.8496
-12.5621 -12.5621 -12.4711 -12.4711 -12.4273 -12.4273 -12.3330 -12.3330
1.4409 1.4409 2.1519 2.1519 2.2330 2.2330 2.2457 2.2457
2.3224 2.3224 2.5102 2.5102 2.5675 2.5675 2.5843 2.5843
2.6241 2.6241 2.6824 2.6824 2.6928 2.6928 3.9608 3.9608
5.9054 5.9054 7.7147 7.7147 8.4982 8.4982 9.1412 9.1412
9.2565 9.2565 9.4628 9.4628 10.4853 10.4853 11.1936 11.1936
11.2788 11.2788 11.7640 11.7640 11.9759 11.9759
k = 0.1341 0.0774-0.0000 ( 4249 PWs) bands (ev):
-32.8855 -32.8855 -32.8613 -32.8613 -13.9277 -13.9277 -13.8502 -13.8502
-12.5622 -12.5622 -12.4722 -12.4722 -12.4283 -12.4283 -12.3333 -12.3333
1.4745 1.4745 2.1500 2.1500 2.2369 2.2369 2.2466 2.2466
2.3239 2.3239 2.5098 2.5098 2.5676 2.5676 2.5870 2.5870
2.6253 2.6253 2.6831 2.6831 2.6924 2.6924 3.9708 3.9708
5.9472 5.9472 7.5987 7.5987 8.5073 8.5073 9.0306 9.0306
9.1827 9.1827 9.4469 9.4469 10.4014 10.4014 11.2252 11.2252
11.2990 11.2990 11.8717 11.8717 12.0364 12.0364
k = 0.1463 0.0845-0.0000 ( 4245 PWs) bands (ev):
-32.8855 -32.8855 -32.8612 -32.8612 -13.9281 -13.9281 -13.8508 -13.8508
-12.5623 -12.5623 -12.4735 -12.4735 -12.4293 -12.4293 -12.3335 -12.3335
1.5110 1.5110 2.1483 2.1483 2.2398 2.2398 2.2484 2.2484
2.3256 2.3256 2.5095 2.5095 2.5679 2.5679 2.5900 2.5900
2.6266 2.6266 2.6833 2.6833 2.6926 2.6926 3.9818 3.9818
5.9927 5.9927 7.4803 7.4803 8.5171 8.5171 8.9163 8.9163
9.1091 9.1091 9.4288 9.4288 10.3168 10.3168 11.2596 11.2596
11.3228 11.3228 11.9434 11.9434 11.9980 11.9980
k = 0.1585 0.0915-0.0000 ( 4247 PWs) bands (ev):
-32.8854 -32.8854 -32.8611 -32.8611 -13.9284 -13.9284 -13.8515 -13.8515
-12.5624 -12.5624 -12.4749 -12.4749 -12.4304 -12.4304 -12.3337 -12.3337
1.5503 1.5503 2.1469 2.1469 2.2415 2.2415 2.2514 2.2514
2.3274 2.3274 2.5093 2.5093 2.5682 2.5682 2.5931 2.5931
2.6279 2.6279 2.6830 2.6830 2.6935 2.6935 3.9938 3.9938
6.0416 6.0416 7.3600 7.3600 8.5274 8.5274 8.7993 8.7993
9.0363 9.0363 9.4083 9.4083 10.2319 10.2319 11.2968 11.2968
11.3502 11.3502 11.9216 11.9216 12.0149 12.0149
k = 0.1707 0.0986-0.0000 ( 4260 PWs) bands (ev):
-32.8853 -32.8853 -32.8611 -32.8611 -13.9288 -13.9288 -13.8523 -13.8523
-12.5625 -12.5625 -12.4763 -12.4763 -12.4315 -12.4315 -12.3340 -12.3340
1.5921 1.5921 2.1457 2.1457 2.2424 2.2424 2.2551 2.2551
2.3294 2.3294 2.5092 2.5092 2.5687 2.5687 2.5964 2.5964
2.6293 2.6293 2.6822 2.6822 2.6951 2.6951 4.0068 4.0068
6.0939 6.0939 7.2384 7.2384 8.5379 8.5379 8.6808 8.6808
8.9644 8.9644 9.3852 9.3852 10.1472 10.1472 11.3366 11.3366
11.3810 11.3810 11.8722 11.8722 12.0265 12.0265
k = 0.1829 0.1056-0.0000 ( 4272 PWs) bands (ev):
-32.8852 -32.8852 -32.8610 -32.8610 -13.9292 -13.9292 -13.8530 -13.8530
-12.5627 -12.5627 -12.4777 -12.4777 -12.4327 -12.4327 -12.3343 -12.3343
1.6364 1.6364 2.1448 2.1448 2.2431 2.2431 2.2591 2.2591
2.3317 2.3317 2.5092 2.5092 2.5694 2.5694 2.5997 2.5997
2.6307 2.6307 2.6811 2.6811 2.6971 2.6971 4.0208 4.0208
6.1495 6.1495 7.1159 7.1159 8.5427 8.5427 8.5675 8.5675
8.8939 8.8939 9.3597 9.3597 10.0630 10.0630 11.3790 11.3790
11.4152 11.4152 11.8217 11.8217 12.0194 12.0194
k = 0.1951 0.1127-0.0000 ( 4272 PWs) bands (ev):
-32.8851 -32.8851 -32.8609 -32.8609 -13.9296 -13.9296 -13.8538 -13.8538
-12.5628 -12.5628 -12.4793 -12.4793 -12.4339 -12.4339 -12.3345 -12.3345
1.6829 1.6829 2.1441 2.1441 2.2440 2.2440 2.2632 2.2632
2.3342 2.3342 2.5093 2.5093 2.5703 2.5703 2.6032 2.6032
2.6321 2.6321 2.6799 2.6799 2.6996 2.6996 4.0357 4.0357
6.2083 6.2083 6.9926 6.9926 8.4384 8.4384 8.5630 8.5630
8.8249 8.8249 9.3317 9.3317 9.9797 9.9797 11.4235 11.4235
11.4526 11.4526 11.7720 11.7720 12.0032 12.0032
k = 0.2073 0.1197-0.0000 ( 4272 PWs) bands (ev):
-32.8850 -32.8850 -32.8609 -32.8609 -13.9300 -13.9300 -13.8547 -13.8547
-12.5629 -12.5629 -12.4808 -12.4808 -12.4352 -12.4352 -12.3348 -12.3348
1.7313 1.7313 2.1437 2.1437 2.2449 2.2449 2.2671 2.2671
2.3372 2.3372 2.5096 2.5096 2.5715 2.5715 2.6067 2.6067
2.6335 2.6335 2.6787 2.6787 2.7024 2.7024 4.0516 4.0516
6.2701 6.2701 6.8689 6.8689 8.3187 8.3187 8.5744 8.5744
8.7578 8.7578 9.3013 9.3013 9.8974 9.8974 11.4697 11.4697
11.4935 11.4935 11.7236 11.7236 11.9843 11.9843
k = 0.2195 0.1267-0.0000 ( 4268 PWs) bands (ev):
-32.8849 -32.8849 -32.8608 -32.8608 -13.9304 -13.9304 -13.8555 -13.8555
-12.5631 -12.5631 -12.4824 -12.4824 -12.4364 -12.4364 -12.3351 -12.3351
1.7813 1.7813 2.1436 2.1436 2.2463 2.2463 2.2709 2.2709
2.3405 2.3405 2.5100 2.5100 2.5730 2.5730 2.6103 2.6103
2.6349 2.6349 2.6775 2.6775 2.7057 2.7057 4.0685 4.0685
6.3348 6.3348 6.7449 6.7449 8.1994 8.1994 8.5863 8.5863
8.6927 8.6927 9.2687 9.2687 9.8163 9.8163 11.5164 11.5164
11.5385 11.5385 11.6772 11.6772 11.9662 11.9662
k = 0.2317 0.1338-0.0000 ( 4260 PWs) bands (ev):
-32.8849 -32.8849 -32.8607 -32.8607 -13.9309 -13.9309 -13.8563 -13.8563
-12.5632 -12.5632 -12.4841 -12.4841 -12.4377 -12.4377 -12.3354 -12.3354
1.8322 1.8322 2.1437 2.1437 2.2482 2.2482 2.2746 2.2746
2.3445 2.3445 2.5106 2.5106 2.5748 2.5748 2.6140 2.6140
2.6362 2.6362 2.6763 2.6763 2.7094 2.7094 4.0864 4.0864
6.4022 6.4022 6.6208 6.6208 8.0810 8.0810 8.5971 8.5971
8.6311 8.6311 9.2340 9.2340 9.7366 9.7366 11.5617 11.5617
11.5879 11.5879 11.6338 11.6338 11.9509 11.9509
k = 0.2439 0.1408-0.0000 ( 4262 PWs) bands (ev):
-32.8848 -32.8848 -32.8606 -32.8606 -13.9313 -13.9313 -13.8572 -13.8572
-12.5634 -12.5634 -12.4857 -12.4857 -12.4390 -12.4390 -12.3356 -12.3356
1.8833 1.8833 2.1440 2.1440 2.2508 2.2508 2.2780 2.2780
2.3493 2.3493 2.5114 2.5114 2.5772 2.5772 2.6176 2.6176
2.6375 2.6375 2.6753 2.6753 2.7138 2.7138 4.1051 4.1051
6.4715 6.4715 6.4973 6.4973 7.9642 7.9642 8.5661 8.5661
8.6134 8.6134 9.1976 9.1976 9.6583 9.6583 11.5795 11.5795
11.6196 11.6196 11.6413 11.6413 11.9398 11.9398
k = 0.2561 0.1479-0.0000 ( 4270 PWs) bands (ev):
-32.8847 -32.8847 -32.8605 -32.8605 -13.9317 -13.9317 -13.8581 -13.8581
-12.5635 -12.5635 -12.4874 -12.4874 -12.4403 -12.4403 -12.3359 -12.3359
1.9337 1.9337 2.1445 2.1445 2.2543 2.2543 2.2811 2.2811
2.3554 2.3554 2.5122 2.5122 2.5802 2.5802 2.6212 2.6212
2.6387 2.6387 2.6743 2.6743 2.7190 2.7190 4.1248 4.1248
6.3720 6.3720 6.5451 6.5451 7.8492 7.8492 8.5083 8.5083
8.6249 8.6249 9.1597 9.1597 9.5815 9.5815 11.5430 11.5430
11.6618 11.6618 11.6977 11.6977 11.9335 11.9335
k = 0.2683 0.1549-0.0000 ( 4274 PWs) bands (ev):
-32.8846 -32.8846 -32.8605 -32.8605 -13.9322 -13.9322 -13.8589 -13.8589
-12.5637 -12.5637 -12.4890 -12.4890 -12.4415 -12.4415 -12.3362 -12.3362
1.9818 1.9818 2.1454 2.1454 2.2590 2.2590 2.2841 2.2841
2.3632 2.3632 2.5133 2.5133 2.5840 2.5840 2.6248 2.6248
2.6399 2.6399 2.6735 2.6735 2.7253 2.7253 4.1453 4.1453
6.2480 6.2480 6.6198 6.6198 7.7366 7.7366 8.4521 8.4521
8.6370 8.6370 9.1208 9.1208 9.5062 9.5062 11.5040 11.5040
11.7083 11.7083 11.7567 11.7567 11.9327 11.9327
k = 0.2805 0.1619-0.0000 ( 4270 PWs) bands (ev):
-32.8845 -32.8845 -32.8604 -32.8604 -13.9326 -13.9326 -13.8598 -13.8598
-12.5638 -12.5638 -12.4907 -12.4907 -12.4428 -12.4428 -12.3364 -12.3364
2.0260 2.0260 2.1466 2.1466 2.2650 2.2650 2.2868 2.2868
2.3734 2.3734 2.5144 2.5144 2.5888 2.5888 2.6284 2.6284
2.6410 2.6410 2.6728 2.6728 2.7334 2.7334 4.1666 4.1666
6.1241 6.1241 6.6966 6.6966 7.6265 7.6265 8.3982 8.3982
8.6492 8.6492 9.0811 9.0811 9.4325 9.4325 11.4664 11.4664
11.7545 11.7545 11.8177 11.8177 11.9384 11.9384
k = 0.2927 0.1690-0.0000 ( 4264 PWs) bands (ev):
-32.8844 -32.8844 -32.8603 -32.8603 -13.9330 -13.9330 -13.8606 -13.8606
-12.5640 -12.5640 -12.4923 -12.4923 -12.4440 -12.4440 -12.3367 -12.3367
2.0640 2.0640 2.1484 2.1484 2.2724 2.2724 2.2892 2.2892
2.3869 2.3869 2.5157 2.5157 2.5950 2.5950 2.6318 2.6318
2.6420 2.6420 2.6723 2.6723 2.7440 2.7440 4.1887 4.1887
6.0004 6.0004 6.7754 6.7754 7.5193 7.5193 8.3469 8.3469
8.6611 8.6611 9.0411 9.0411 9.3602 9.3602 11.4305 11.4305
11.7985 11.7985 11.8802 11.8802 11.9516 11.9516
k = 0.3049 0.1760-0.0000 ( 4260 PWs) bands (ev):
-32.8843 -32.8843 -32.8602 -32.8602 -13.9335 -13.9335 -13.8614 -13.8614
-12.5641 -12.5641 -12.4938 -12.4938 -12.4452 -12.4452 -12.3369 -12.3369
2.0940 2.0940 2.1511 2.1511 2.2804 2.2804 2.2915 2.2915
2.4041 2.4041 2.5170 2.5170 2.6025 2.6025 2.6352 2.6352
2.6430 2.6430 2.6721 2.6721 2.7585 2.7585 4.2113 4.2113
5.8770 5.8770 6.8557 6.8557 7.4153 7.4153 8.2981 8.2981
8.6728 8.6728 9.0011 9.0011 9.2893 9.2893 11.3965 11.3965
11.8382 11.8382 11.9435 11.9435 11.9746 11.9746
k = 0.3171 0.1831-0.0000 ( 4264 PWs) bands (ev):
-32.8842 -32.8842 -32.8601 -32.8601 -13.9339 -13.9339 -13.8622 -13.8622
-12.5643 -12.5643 -12.4954 -12.4954 -12.4464 -12.4464 -12.3371 -12.3371
2.1149 2.1149 2.1553 2.1553 2.2881 2.2881 2.2939 2.2939
2.4241 2.4241 2.5184 2.5184 2.6115 2.6115 2.6383 2.6383
2.6440 2.6440 2.6720 2.6720 2.7787 2.7787 4.2346 4.2346
5.7539 5.7539 6.9375 6.9375 7.3149 7.3149 8.2520 8.2520
8.6840 8.6840 8.9616 8.9616 9.2198 9.2198 11.3643 11.3643
11.8720 11.8720 11.9995 11.9995 12.0157 12.0157
k = 0.3293 0.1901-0.0000 ( 4260 PWs) bands (ev):
-32.8841 -32.8841 -32.8601 -32.8601 -13.9343 -13.9343 -13.8630 -13.8630
-12.5644 -12.5644 -12.4968 -12.4968 -12.4475 -12.4475 -12.3374 -12.3374
2.1273 2.1273 2.1613 2.1613 2.2932 2.2932 2.2981 2.2981
2.4450 2.4450 2.5197 2.5197 2.6215 2.6215 2.6411 2.6411
2.6452 2.6452 2.6721 2.6721 2.8069 2.8069 4.2582 4.2582
5.6313 5.6313 7.0202 7.0202 7.2185 7.2185 8.2086 8.2086
8.6949 8.6949 8.9230 8.9230 9.1515 9.1515 11.3340 11.3340
11.9005 11.9005 12.0431 12.0431 12.0785 12.0785
k = 0.3415 0.1971-0.0000 ( 4272 PWs) bands (ev):
-32.8841 -32.8841 -32.8600 -32.8600 -13.9347 -13.9347 -13.8638 -13.8638
-12.5646 -12.5646 -12.4983 -12.4983 -12.4486 -12.4486 -12.3376 -12.3376
2.1337 2.1337 2.1681 2.1681 2.2953 2.2953 2.3037 2.3037
2.4642 2.4642 2.5211 2.5211 2.6312 2.6312 2.6432 2.6432
2.6471 2.6471 2.6725 2.6725 2.8452 2.8452 4.2822 4.2822
5.5091 5.5091 7.0986 7.0986 7.1316 7.1316 8.1680 8.1680
8.7052 8.7052 8.8856 8.8856 9.0844 9.0844 11.3055 11.3055
11.9256 11.9256 12.0897 12.0897 12.1441 12.1441
k = 0.3537 0.2042-0.0000 ( 4270 PWs) bands (ev):
-32.8840 -32.8840 -32.8599 -32.8599 -13.9350 -13.9350 -13.8645 -13.8645
-12.5647 -12.5647 -12.4996 -12.4996 -12.4496 -12.4496 -12.3378 -12.3378
2.1372 2.1372 2.1743 2.1743 2.2966 2.2966 2.3089 2.3089
2.4804 2.4804 2.5225 2.5225 2.6388 2.6388 2.6457 2.6457
2.6497 2.6497 2.6731 2.6731 2.8946 2.8946 4.3062 4.3062
5.3874 5.3874 7.0356 7.0356 7.1911 7.1911 8.1302 8.1302
8.7149 8.7149 8.8497 8.8497 9.0183 9.0183 11.2789 11.2789
11.9491 11.9491 12.1389 12.1389 12.2090 12.2090
k = 0.3659 0.2112-0.0000 ( 4276 PWs) bands (ev):
-32.8839 -32.8839 -32.8599 -32.8599 -13.9354 -13.9354 -13.8651 -13.8651
-12.5649 -12.5649 -12.5009 -12.5009 -12.4505 -12.4505 -12.3379 -12.3379
2.1392 2.1392 2.1793 2.1793 2.2976 2.2976 2.3132 2.3132
2.4930 2.4930 2.5238 2.5238 2.6419 2.6419 2.6499 2.6499
2.6531 2.6531 2.6739 2.6739 2.9545 2.9545 4.3301 4.3301
5.2664 5.2664 6.9528 6.9528 7.2757 7.2757 8.0952 8.0952
8.7240 8.7240 8.8156 8.8156 8.9530 8.9530 11.2542 11.2542
11.9720 11.9720 12.1890 12.1890 12.2265 12.2265
k = 0.3780 0.2183-0.0000 ( 4280 PWs) bands (ev):
-32.8838 -32.8838 -32.8598 -32.8598 -13.9357 -13.9357 -13.8657 -13.8657
-12.5650 -12.5650 -12.5021 -12.5021 -12.4514 -12.4514 -12.3381 -12.3381
2.1404 2.1404 2.1833 2.1833 2.2984 2.2984 2.3168 2.3168
2.5026 2.5026 2.5252 2.5252 2.6429 2.6429 2.6535 2.6535
2.6574 2.6574 2.6749 2.6749 3.0235 3.0235 4.3536 4.3536
5.1460 5.1460 6.8746 6.8746 7.3608 7.3608 8.0632 8.0632
8.7321 8.7321 8.7839 8.7839 8.8884 8.8884 11.2314 11.2314
11.9945 11.9945 12.2144 12.2144 12.2402 12.2402
k = 0.3902 0.2253-0.0000 ( 4280 PWs) bands (ev):
-32.8838 -32.8838 -32.8598 -32.8598 -13.9360 -13.9360 -13.8663 -13.8663
-12.5652 -12.5652 -12.5032 -12.5032 -12.4522 -12.4522 -12.3383 -12.3383
2.1413 2.1413 2.1865 2.1865 2.2990 2.2990 2.3199 2.3199
2.5098 2.5098 2.5266 2.5266 2.6432 2.6432 2.6561 2.6561
2.6615 2.6615 2.6762 2.6762 3.0998 3.0998 4.3765 4.3765
5.0264 5.0264 6.8019 6.8019 7.4458 7.4458 8.0341 8.0341
8.7383 8.7383 8.7555 8.7555 8.8245 8.8245 11.2105 11.2105
12.0164 12.0164 12.2049 12.2049 12.2888 12.2888
k = 0.4024 0.2323-0.0000 ( 4280 PWs) bands (ev):
-32.8837 -32.8837 -32.8597 -32.8597 -13.9363 -13.9363 -13.8669 -13.8669
-12.5653 -12.5653 -12.5042 -12.5042 -12.4529 -12.4529 -12.3384 -12.3384
2.1419 2.1419 2.1891 2.1891 2.2994 2.2994 2.3224 2.3224
2.5151 2.5151 2.5282 2.5282 2.6434 2.6434 2.6583 2.6583
2.6646 2.6646 2.6776 2.6776 3.1820 3.1820 4.3985 4.3985
4.9078 4.9078 6.7352 6.7352 7.5303 7.5303 8.0080 8.0080
8.7248 8.7248 8.7454 8.7454 8.7641 8.7641 11.1915 11.1915
12.0375 12.0375 12.1962 12.1962 12.3356 12.3356
k = 0.4146 0.2394-0.0000 ( 4284 PWs) bands (ev):
-32.8837 -32.8837 -32.8597 -32.8597 -13.9365 -13.9365 -13.8673 -13.8673
-12.5654 -12.5654 -12.5051 -12.5051 -12.4536 -12.4536 -12.3385 -12.3385
2.1423 2.1423 2.1912 2.1912 2.2998 2.2998 2.3245 2.3245
2.5189 2.5189 2.5298 2.5298 2.6435 2.6435 2.6603 2.6603
2.6669 2.6669 2.6790 2.6790 3.2690 3.2690 4.4191 4.4191
4.7903 4.7903 6.6747 6.6747 7.6139 7.6139 7.9849 7.9849
8.6926 8.6926 8.7035 8.7035 8.7562 8.7562 11.1746 11.1746
12.0573 12.0573 12.1888 12.1888 12.3797 12.3797
k = 0.4268 0.2464-0.0000 ( 4284 PWs) bands (ev):
-32.8836 -32.8836 -32.8596 -32.8596 -13.9368 -13.9368 -13.8677 -13.8677
-12.5655 -12.5655 -12.5059 -12.5059 -12.4542 -12.4542 -12.3386 -12.3386
2.1426 2.1426 2.1929 2.1929 2.3000 2.3000 2.3263 2.3263
2.5215 2.5215 2.5316 2.5316 2.6435 2.6435 2.6620 2.6620
2.6686 2.6686 2.6804 2.6804 3.3598 3.3598 4.4381 4.4381
4.6740 4.6740 6.6211 6.6211 7.6962 7.6962 7.9649 7.9649
8.6307 8.6307 8.6809 8.6809 8.7610 8.7610 11.1597 11.1597
12.0755 12.0755 12.1827 12.1827 12.4201 12.4201
k = 0.4390 0.2535-0.0000 ( 4292 PWs) bands (ev):
-32.8836 -32.8836 -32.8596 -32.8596 -13.9369 -13.9369 -13.8681 -13.8681
-12.5655 -12.5655 -12.5066 -12.5066 -12.4547 -12.4547 -12.3387 -12.3387
2.1427 2.1427 2.1943 2.1943 2.3002 2.3002 2.3278 2.3278
2.5232 2.5232 2.5334 2.5334 2.6435 2.6435 2.6634 2.6634
2.6700 2.6700 2.6815 2.6815 3.4535 3.4535 4.4550 4.4550
4.5593 4.5593 6.5747 6.5747 7.7764 7.7764 7.9479 7.9479
8.5671 8.5671 8.6625 8.6625 8.7656 8.7656 11.1469 11.1469
12.0914 12.0914 12.1779 12.1779 12.4560 12.4560
k = 0.4512 0.2605-0.0000 ( 4288 PWs) bands (ev):
-32.8836 -32.8836 -32.8596 -32.8596 -13.9371 -13.9371 -13.8684 -13.8684
-12.5656 -12.5656 -12.5071 -12.5071 -12.4551 -12.4551 -12.3388 -12.3388
2.1429 2.1429 2.1953 2.1953 2.3003 2.3003 2.3289 2.3289
2.5243 2.5243 2.5350 2.5350 2.6435 2.6435 2.6646 2.6646
2.6710 2.6710 2.6825 2.6825 3.5494 3.5494 4.4463 4.4463
4.4699 4.4699 6.5361 6.5361 7.8539 7.8539 7.9341 7.9341
8.5039 8.5039 8.6474 8.6474 8.7693 8.7693 11.1363 11.1363
12.1047 12.1047 12.1744 12.1744 12.4867 12.4867
k = 0.4634 0.2676-0.0000 ( 4280 PWs) bands (ev):
-32.8835 -32.8835 -32.8596 -32.8596 -13.9372 -13.9372 -13.8686 -13.8686
-12.5657 -12.5657 -12.5075 -12.5075 -12.4554 -12.4554 -12.3389 -12.3389
2.1430 2.1430 2.1962 2.1962 2.3004 2.3004 2.3298 2.3298
2.5251 2.5251 2.5363 2.5363 2.6434 2.6434 2.6655 2.6655
2.6718 2.6718 2.6832 2.6832 3.6462 3.6462 4.3369 4.3369
4.4814 4.4814 6.5055 6.5055 7.9197 7.9197 7.9310 7.9310
8.4419 8.4419 8.6355 8.6355 8.7723 8.7723 11.1279 11.1279
12.1150 12.1150 12.1722 12.1722 12.5115 12.5115
k = 0.4756 0.2746-0.0000 ( 4272 PWs) bands (ev):
-32.8835 -32.8835 -32.8595 -32.8595 -13.9373 -13.9373 -13.8688 -13.8688
-12.5657 -12.5657 -12.5079 -12.5079 -12.4556 -12.4556 -12.3389 -12.3389
2.1430 2.1430 2.1968 2.1968 2.3005 2.3005 2.3305 2.3305
2.5256 2.5256 2.5372 2.5372 2.6434 2.6434 2.6662 2.6662
2.6723 2.6723 2.6838 2.6838 3.7414 3.7414 4.2328 4.2328
4.4900 4.4900 6.4834 6.4834 7.9148 7.9148 7.9946 7.9946
8.3839 8.3839 8.6270 8.6270 8.7745 8.7745 11.1219 11.1219
12.1221 12.1221 12.1712 12.1712 12.5297 12.5297
k = 0.4878 0.2816-0.0000 ( 4270 PWs) bands (ev):
-32.8835 -32.8835 -32.8595 -32.8595 -13.9373 -13.9373 -13.8689 -13.8689
-12.5657 -12.5657 -12.5081 -12.5081 -12.4557 -12.4557 -12.3390 -12.3390
2.1431 2.1431 2.1971 2.1971 2.3005 2.3005 2.3308 2.3308
2.5259 2.5259 2.5378 2.5378 2.6434 2.6434 2.6665 2.6665
2.6727 2.6727 2.6841 2.6841 3.8266 3.8266 4.1421 4.1421
4.4953 4.4953 6.4700 6.4700 7.9103 7.9103 8.0467 8.0467
8.3369 8.3369 8.6218 8.6218 8.7758 8.7758 11.1183 11.1183
12.1262 12.1262 12.1708 12.1708 12.5408 12.5408
k = 0.5000 0.2887-0.0000 ( 4278 PWs) bands (ev):
-32.8835 -32.8835 -32.8595 -32.8595 -13.9373 -13.9373 -13.8689 -13.8689
-12.5657 -12.5657 -12.5081 -12.5081 -12.4558 -12.4558 -12.3390 -12.3390
2.1431 2.1431 2.1972 2.1972 2.3005 2.3005 2.3309 2.3309
2.5259 2.5259 2.5380 2.5380 2.6434 2.6434 2.6666 2.6666
2.6728 2.6728 2.6842 2.6842 3.8693 3.8693 4.0976 4.0976
4.4971 4.4971 6.4655 6.4655 7.9087 7.9087 8.0684 8.0684
8.3170 8.3170 8.6201 8.6201 8.7762 8.7762 11.1170 11.1170
12.1275 12.1275 12.1708 12.1708 12.5446 12.5446
k = 0.5000 0.2887-0.0000 ( 4278 PWs) bands (ev):
-32.8835 -32.8835 -32.8595 -32.8595 -13.9373 -13.9373 -13.8689 -13.8689
-12.5657 -12.5657 -12.5081 -12.5081 -12.4558 -12.4558 -12.3390 -12.3390
2.1431 2.1431 2.1972 2.1972 2.3005 2.3005 2.3309 2.3309
2.5259 2.5259 2.5380 2.5380 2.6434 2.6434 2.6666 2.6666
2.6728 2.6728 2.6842 2.6842 3.8693 3.8693 4.0976 4.0976
4.4971 4.4971 6.4655 6.4655 7.9087 7.9087 8.0684 8.0684
8.3170 8.3170 8.6201 8.6201 8.7762 8.7762 11.1170 11.1170
12.1275 12.1275 12.1708 12.1708 12.5446 12.5446
k = 0.4931 0.3007-0.0000 ( 4272 PWs) bands (ev):
-32.8835 -32.8835 -32.8595 -32.8595 -13.9373 -13.9373 -13.8689 -13.8689
-12.5657 -12.5657 -12.5081 -12.5081 -12.4558 -12.4558 -12.3390 -12.3390
2.1431 2.1431 2.1975 2.1975 2.3006 2.3006 2.3309 2.3309
2.5241 2.5241 2.5398 2.5398 2.6434 2.6434 2.6666 2.6666
2.6727 2.6727 2.6842 2.6842 3.8703 3.8703 4.0994 4.0994
4.4982 4.4982 6.4605 6.4605 7.9123 7.9123 8.0699 8.0699
8.3169 8.3169 8.5384 8.5384 8.8567 8.8567 11.1182 11.1182
12.1267 12.1267 12.1691 12.1691 12.5464 12.5464
k = 0.4861 0.3127-0.0000 ( 4274 PWs) bands (ev):
-32.8835 -32.8835 -32.8595 -32.8595 -13.9374 -13.9374 -13.8690 -13.8690
-12.5657 -12.5657 -12.5082 -12.5082 -12.4559 -12.4559 -12.3390 -12.3390
2.1431 2.1431 2.1984 2.1984 2.3006 2.3006 2.3308 2.3308
2.5201 2.5201 2.5436 2.5436 2.6435 2.6435 2.6663 2.6663
2.6727 2.6727 2.6842 2.6842 3.8731 3.8731 4.1047 4.1047
4.5014 4.5014 6.4456 6.4456 7.9228 7.9228 8.0742 8.0742
8.3165 8.3165 8.4080 8.4080 8.9836 8.9836 11.1215 11.1215
12.1243 12.1243 12.1642 12.1642 12.5516 12.5516
k = 0.4792 0.3248-0.0000 ( 4284 PWs) bands (ev):
-32.8835 -32.8835 -32.8595 -32.8595 -13.9374 -13.9374 -13.8690 -13.8690
-12.5657 -12.5657 -12.5083 -12.5083 -12.4560 -12.4560 -12.3390 -12.3390
2.1432 2.1432 2.1998 2.1998 2.3007 2.3007 2.3307 2.3307
2.5154 2.5154 2.5479 2.5479 2.6436 2.6436 2.6658 2.6658
2.6725 2.6725 2.6841 2.6841 3.8777 3.8777 4.1135 4.1135
4.5069 4.5069 6.4215 6.4215 7.9395 7.9395 8.0814 8.0814
8.2680 8.2680 8.3188 8.3188 9.1147 9.1147 11.1271 11.1271
12.1199 12.1199 12.1569 12.1569 12.5602 12.5602
k = 0.4722 0.3368-0.0000 ( 4283 PWs) bands (ev):
-32.8835 -32.8835 -32.8595 -32.8595 -13.9374 -13.9374 -13.8691 -13.8691
-12.5657 -12.5657 -12.5084 -12.5084 -12.4562 -12.4562 -12.3391 -12.3391
2.1434 2.1434 2.2017 2.2017 2.3009 2.3009 2.3304 2.3304
2.5105 2.5105 2.5524 2.5524 2.6437 2.6437 2.6651 2.6651
2.6724 2.6724 2.6841 2.6841 3.8843 3.8843 4.1257 4.1257
4.5145 4.5145 6.3889 6.3889 7.9615 7.9615 8.0913 8.0913
8.1294 8.1294 8.3178 8.3178 9.2455 9.2455 11.1349 11.1349
12.1127 12.1127 12.1479 12.1479 12.5718 12.5718
k = 0.4653 0.3488-0.0000 ( 4293 PWs) bands (ev):
-32.8835 -32.8835 -32.8595 -32.8595 -13.9375 -13.9375 -13.8692 -13.8692
-12.5656 -12.5656 -12.5085 -12.5085 -12.4564 -12.4564 -12.3392 -12.3392
2.1436 2.1436 2.2041 2.2041 2.3010 2.3010 2.3301 2.3301
2.5055 2.5055 2.5569 2.5569 2.6439 2.6439 2.6643 2.6643
2.6722 2.6722 2.6840 2.6840 3.8927 3.8927 4.1411 4.1411
4.5243 4.5243 6.3490 6.3490 7.9825 7.9825 7.9940 7.9940
8.1041 8.1041 8.3178 8.3178 9.3747 9.3747 11.1448 11.1448
12.1021 12.1021 12.1384 12.1384 12.5863 12.5863
k = 0.4583 0.3608-0.0000 ( 4289 PWs) bands (ev):
-32.8835 -32.8835 -32.8595 -32.8595 -13.9375 -13.9375 -13.8693 -13.8693
-12.5655 -12.5655 -12.5087 -12.5087 -12.4566 -12.4566 -12.3393 -12.3393
2.1438 2.1438 2.2071 2.2071 2.3012 2.3012 2.3298 2.3298
2.5005 2.5005 2.5614 2.5614 2.6441 2.6441 2.6635 2.6635
2.6719 2.6719 2.6839 2.6839 3.9031 3.9031 4.1598 4.1598
4.5364 4.5364 6.3027 6.3027 7.8472 7.8472 8.0180 8.0180
8.1193 8.1193 8.3181 8.3181 9.5016 9.5016 11.1570 11.1570
12.0880 12.0880 12.1287 12.1287 12.5929 12.5929
k = 0.4514 0.3729-0.0000 ( 4289 PWs) bands (ev):
-32.8835 -32.8835 -32.8595 -32.8595 -13.9376 -13.9376 -13.8694 -13.8694
-12.5655 -12.5655 -12.5089 -12.5089 -12.4569 -12.4569 -12.3394 -12.3394
2.1441 2.1441 2.2104 2.2104 2.3014 2.3014 2.3294 2.3294
2.4955 2.4955 2.5658 2.5658 2.6443 2.6443 2.6625 2.6625
2.6717 2.6717 2.6838 2.6838 3.9153 3.9153 4.1813 4.1813
4.5507 4.5507 6.2512 6.2512 7.7066 7.7066 8.0495 8.0495
8.1369 8.1369 8.3187 8.3187 9.6260 9.6260 11.1714 11.1714
12.0710 12.0710 12.1184 12.1184 12.5628 12.5628
k = 0.4444 0.3849-0.0000 ( 4287 PWs) bands (ev):
-32.8834 -32.8834 -32.8595 -32.8595 -13.9377 -13.9377 -13.8695 -13.8695
-12.5654 -12.5654 -12.5091 -12.5091 -12.4572 -12.4572 -12.3395 -12.3395
2.1445 2.1445 2.2142 2.2142 2.3017 2.3017 2.3289 2.3289
2.4907 2.4907 2.5701 2.5701 2.6445 2.6445 2.6614 2.6614
2.6714 2.6714 2.6836 2.6836 3.9295 3.9295 4.2056 4.2056
4.5672 4.5672 6.1955 6.1955 7.5667 7.5667 8.0819 8.0819
8.1567 8.1567 8.3196 8.3196 9.7476 9.7476 11.1878 11.1878
12.0519 12.0519 12.1070 12.1070 12.5262 12.5262
k = 0.4375 0.3969-0.0000 ( 4291 PWs) bands (ev):
-32.8834 -32.8834 -32.8595 -32.8595 -13.9377 -13.9377 -13.8696 -13.8696
-12.5653 -12.5653 -12.5093 -12.5093 -12.4576 -12.4576 -12.3397 -12.3397
2.1448 2.1448 2.2182 2.2182 2.3019 2.3019 2.3284 2.3284
2.4859 2.4859 2.5742 2.5742 2.6447 2.6447 2.6603 2.6603
2.6710 2.6710 2.6834 2.6834 3.9456 3.9456 4.2324 4.2324
4.5861 4.5861 6.1363 6.1363 7.4278 7.4278 8.1143 8.1143
8.1786 8.1786 8.3210 8.3210 9.8660 9.8660 11.2064 11.2064
12.0314 12.0314 12.0938 12.0938 12.4842 12.4842
k = 0.4306 0.4090-0.0000 ( 4295 PWs) bands (ev):
-32.8834 -32.8834 -32.8594 -32.8594 -13.9378 -13.9378 -13.8698 -13.8698
-12.5653 -12.5653 -12.5096 -12.5096 -12.4579 -12.4579 -12.3398 -12.3398
2.1452 2.1452 2.2226 2.2226 2.3021 2.3021 2.3278 2.3278
2.4813 2.4813 2.5783 2.5783 2.6449 2.6449 2.6592 2.6592
2.6707 2.6707 2.6832 2.6832 3.9637 3.9637 4.2613 4.2613
4.6074 4.6074 6.0745 6.0745 7.2905 7.2905 8.1458 8.1458
8.2023 8.2023 8.3229 8.3229 9.9812 9.9812 11.2271 11.2271
12.0099 12.0099 12.0785 12.0785 12.4375 12.4375
k = 0.4236 0.4210-0.0000 ( 4305 PWs) bands (ev):
-32.8834 -32.8834 -32.8594 -32.8594 -13.9379 -13.9379 -13.8700 -13.8700
-12.5652 -12.5652 -12.5098 -12.5098 -12.4583 -12.4583 -12.3399 -12.3399
2.1455 2.1455 2.2271 2.2271 2.3023 2.3023 2.3271 2.3271
2.4769 2.4769 2.5822 2.5822 2.6450 2.6450 2.6581 2.6581
2.6704 2.6704 2.6829 2.6829 3.9837 3.9837 4.2920 4.2920
4.6310 4.6310 6.0106 6.0106 7.1553 7.1553 8.1754 8.1754
8.2276 8.2276 8.3256 8.3256 10.0930 10.0930 11.2498 11.2498
11.9879 11.9879 12.0607 12.0607 12.3872 12.3872
k = 0.4167 0.4330-0.0000 ( 4305 PWs) bands (ev):
-32.8834 -32.8834 -32.8594 -32.8594 -13.9380 -13.9380 -13.8701 -13.8701
-12.5651 -12.5651 -12.5101 -12.5101 -12.4587 -12.4587 -12.3401 -12.3401
2.1460 2.1460 2.2319 2.2319 2.3025 2.3025 2.3264 2.3264
2.4727 2.4727 2.5860 2.5860 2.6451 2.6451 2.6572 2.6572
2.6701 2.6701 2.6826 2.6826 4.0057 4.0057 4.3239 4.3239
4.6571 4.6571 5.9454 5.9454 7.0227 7.0227 8.2027 8.2027
8.2539 8.2539 8.3293 8.3293 10.2011 10.2011 11.2746 11.2746
11.9657 11.9657 12.0405 12.0405 12.3343 12.3343
k = 0.4097 0.4450-0.0000 ( 4313 PWs) bands (ev):
-32.8834 -32.8834 -32.8594 -32.8594 -13.9381 -13.9381 -13.8703 -13.8703
-12.5650 -12.5650 -12.5104 -12.5104 -12.4591 -12.4591 -12.3402 -12.3402
2.1464 2.1464 2.2366 2.2366 2.3027 2.3027 2.3256 2.3256
2.4688 2.4688 2.5896 2.5896 2.6450 2.6450 2.6563 2.6563
2.6698 2.6698 2.6822 2.6822 4.0297 4.0297 4.3566 4.3566
4.6856 4.6856 5.8791 5.8791 6.8934 6.8934 8.2271 8.2271
8.2808 8.2808 8.3341 8.3341 10.3054 10.3054 11.3012 11.3012
11.9435 11.9435 12.0176 12.0176 12.2788 12.2788
k = 0.4028 0.4571-0.0000 ( 4321 PWs) bands (ev):
-32.8833 -32.8833 -32.8594 -32.8594 -13.9382 -13.9382 -13.8704 -13.8704
-12.5650 -12.5650 -12.5107 -12.5107 -12.4595 -12.4595 -12.3404 -12.3404
2.1468 2.1468 2.2414 2.2414 2.3029 2.3029 2.3248 2.3248
2.4652 2.4652 2.5930 2.5930 2.6449 2.6449 2.6556 2.6556
2.6696 2.6696 2.6818 2.6818 4.0557 4.0557 4.3893 4.3893
4.7167 4.7167 5.8123 5.8123 6.7681 6.7681 8.2485 8.2485
8.3073 8.3073 8.3406 8.3406 10.4057 10.4057 11.3298 11.3298
11.9214 11.9214 11.9924 11.9924 12.2155 12.2155
k = 0.3958 0.4691-0.0000 ( 4313 PWs) bands (ev):
-32.8833 -32.8833 -32.8594 -32.8594 -13.9383 -13.9383 -13.8706 -13.8706
-12.5649 -12.5649 -12.5109 -12.5109 -12.4599 -12.4599 -12.3405 -12.3405
2.1472 2.1472 2.2462 2.2462 2.3030 2.3030 2.3239 2.3239
2.4620 2.4620 2.5962 2.5962 2.6446 2.6446 2.6550 2.6550
2.6694 2.6694 2.6814 2.6814 4.0837 4.0837 4.4212 4.4212
4.7503 4.7503 5.7453 5.7453 6.6477 6.6477 8.2668 8.2668
8.3317 8.3317 8.3497 8.3497 10.5015 10.5015 11.3603 11.3603
11.8994 11.8994 11.9651 11.9651 12.1425 12.1425
k = 0.3889 0.4811-0.0000 ( 4309 PWs) bands (ev):
-32.8833 -32.8833 -32.8593 -32.8593 -13.9383 -13.9383 -13.8707 -13.8707
-12.5648 -12.5648 -12.5112 -12.5112 -12.4602 -12.4602 -12.3406 -12.3406
2.1476 2.1476 2.2507 2.2507 2.3032 2.3032 2.3229 2.3229
2.4591 2.4591 2.5992 2.5992 2.6443 2.6443 2.6546 2.6546
2.6694 2.6694 2.6809 2.6809 4.1137 4.1137 4.4513 4.4513
4.7865 4.7865 5.6784 5.6784 6.5333 6.5333 8.2821 8.2821
8.3492 8.3492 8.3655 8.3655 10.5926 10.5926 11.3925 11.3925
11.8777 11.8777 11.9364 11.9364 12.0710 12.0710
k = 0.3819 0.4932-0.0000 ( 4313 PWs) bands (ev):
-32.8833 -32.8833 -32.8593 -32.8593 -13.9384 -13.9384 -13.8709 -13.8709
-12.5648 -12.5648 -12.5115 -12.5115 -12.4606 -12.4606 -12.3407 -12.3407
2.1479 2.1479 2.2550 2.2550 2.3034 2.3034 2.3219 2.3219
2.4566 2.4566 2.6018 2.6018 2.6438 2.6438 2.6543 2.6543
2.6694 2.6694 2.6803 2.6803 4.1457 4.1457 4.4782 4.4782
4.8253 4.8253 5.6119 5.6119 6.4263 6.4263 8.2950 8.2950
8.3605 8.3605 8.3862 8.3862 10.6783 10.6783 11.4265 11.4265
11.8558 11.8558 11.9072 11.9072 12.0035 12.0035
k = 0.3750 0.5052-0.0000 ( 4315 PWs) bands (ev):
-32.8833 -32.8833 -32.8593 -32.8593 -13.9385 -13.9385 -13.8710 -13.8710
-12.5647 -12.5647 -12.5117 -12.5117 -12.4609 -12.4609 -12.3409 -12.3409
2.1482 2.1482 2.2589 2.2589 2.3036 2.3036 2.3208 2.3208
2.4545 2.4545 2.6042 2.6042 2.6434 2.6434 2.6542 2.6542
2.6696 2.6696 2.6797 2.6797 4.1798 4.1798 4.5005 4.5005
4.8667 4.8667 5.5459 5.5459 6.3281 6.3281 8.3061 8.3061
8.3702 8.3702 8.4059 8.4059 10.7578 10.7578 11.4621 11.4621
11.8335 11.8335 11.8789 11.8789 11.9414 11.9414
k = 0.3681 0.5172-0.0000 ( 4311 PWs) bands (ev):
-32.8833 -32.8833 -32.8593 -32.8593 -13.9386 -13.9386 -13.8712 -13.8712
-12.5647 -12.5647 -12.5119 -12.5119 -12.4611 -12.4611 -12.3409 -12.3409
2.1485 2.1485 2.2624 2.2624 2.3039 2.3039 2.3198 2.3198
2.4528 2.4528 2.6063 2.6063 2.6430 2.6430 2.6541 2.6541
2.6699 2.6699 2.6791 2.6791 4.2158 4.2158 4.5165 4.5165
4.9107 4.9107 5.4806 5.4806 6.2408 6.2408 8.3157 8.3157
8.3793 8.3793 8.4225 8.4225 10.8301 10.8301 11.4992 11.4992
11.8103 11.8103 11.8533 11.8533 11.8859 11.8859
k = 0.3611 0.5292-0.0000 ( 4311 PWs) bands (ev):
-32.8832 -32.8832 -32.8593 -32.8593 -13.9386 -13.9386 -13.8713 -13.8713
-12.5646 -12.5646 -12.5121 -12.5121 -12.4614 -12.4614 -12.3410 -12.3410
2.1488 2.1488 2.2653 2.2653 2.3043 2.3043 2.3187 2.3187
2.4514 2.4514 2.6079 2.6079 2.6426 2.6426 2.6540 2.6540
2.6703 2.6703 2.6784 2.6784 4.2537 4.2537 4.5241 4.5241
4.9574 4.9574 5.4163 5.4163 6.1662 6.1662 8.3243 8.3243
8.3880 8.3880 8.4351 8.4351 10.8936 10.8936 11.5378 11.5378
11.7870 11.7870 11.8310 11.8310 11.8382 11.8382
k = 0.3542 0.5413-0.0000 ( 4319 PWs) bands (ev):
-32.8832 -32.8832 -32.8593 -32.8593 -13.9387 -13.9387 -13.8713 -13.8713
-12.5646 -12.5646 -12.5123 -12.5123 -12.4616 -12.4616 -12.3411 -12.3411
2.1490 2.1490 2.2676 2.2676 2.3047 2.3047 2.3177 2.3177
2.4504 2.4504 2.6092 2.6092 2.6423 2.6423 2.6540 2.6540
2.6709 2.6709 2.6777 2.6777 4.2934 4.2934 4.5217 4.5217
5.0067 5.0067 5.3530 5.3530 6.1063 6.1063 8.3318 8.3318
8.3965 8.3965 8.4428 8.4428 10.9464 10.9464 11.5776 11.5776
11.7652 11.7652 11.7983 11.7983 11.8130 11.8130
k = 0.3472 0.5533-0.0000 ( 4331 PWs) bands (ev):
-32.8832 -32.8832 -32.8593 -32.8593 -13.9387 -13.9387 -13.8714 -13.8714
-12.5646 -12.5646 -12.5124 -12.5124 -12.4617 -12.4617 -12.3411 -12.3411
2.1491 2.1491 2.2693 2.2693 2.3052 2.3052 2.3168 2.3168
2.4497 2.4497 2.6101 2.6101 2.6420 2.6420 2.6539 2.6539
2.6714 2.6714 2.6769 2.6769 4.3343 4.3343 4.5080 4.5080
5.0586 5.0586 5.2909 5.2909 6.0629 6.0629 8.3379 8.3379
8.4054 8.4054 8.4451 8.4451 10.9862 10.9862 11.6183 11.6183
11.7465 11.7465 11.7683 11.7683 11.7963 11.7963
k = 0.3403 0.5653-0.0000 ( 4325 PWs) bands (ev):
-32.8832 -32.8832 -32.8593 -32.8593 -13.9387 -13.9387 -13.8715 -13.8715
-12.5646 -12.5646 -12.5125 -12.5125 -12.4618 -12.4618 -12.3412 -12.3412
2.1492 2.1492 2.2702 2.2702 2.3055 2.3055 2.3163 2.3163
2.4494 2.4494 2.6107 2.6107 2.6419 2.6419 2.6539 2.6539
2.6720 2.6720 2.6764 2.6764 4.3747 4.3747 4.4841 4.4841
5.1133 5.1133 5.2301 5.2301 6.0368 6.0368 8.3420 8.3420
8.4148 8.4148 8.4420 8.4420 11.0109 11.0109 11.6591 11.6591
11.7274 11.7274 11.7483 11.7483 11.7764 11.7764
k = 0.3333 0.5774-0.0000 ( 4329 PWs) bands (ev):
-32.8832 -32.8832 -32.8593 -32.8593 -13.9388 -13.9388 -13.8715 -13.8715
-12.5646 -12.5646 -12.5125 -12.5125 -12.4618 -12.4618 -12.3412 -12.3412
2.1492 2.1492 2.2706 2.2706 2.3057 2.3057 2.3160 2.3160
2.4493 2.4493 2.6108 2.6108 2.6419 2.6419 2.6539 2.6539
2.6722 2.6722 2.6761 2.6761 4.3997 4.3997 4.4644 4.4644
5.1706 5.1706 5.1707 5.1707 6.0283 6.0283 8.3435 8.3435
8.4216 8.4216 8.4371 8.4371 11.0192 11.0192 11.6950 11.6950
11.7000 11.7000 11.7413 11.7413 11.7671 11.7671
k = 0.3333 0.5774-0.0000 ( 4329 PWs) bands (ev):
-32.8832 -32.8832 -32.8593 -32.8593 -13.9388 -13.9388 -13.8715 -13.8715
-12.5646 -12.5646 -12.5125 -12.5125 -12.4618 -12.4618 -12.3412 -12.3412
2.1492 2.1492 2.2706 2.2706 2.3057 2.3057 2.3160 2.3160
2.4493 2.4493 2.6108 2.6108 2.6419 2.6419 2.6539 2.6539
2.6722 2.6722 2.6761 2.6761 4.3997 4.3997 4.4644 4.4644
5.1706 5.1706 5.1707 5.1707 6.0283 6.0283 8.3435 8.3435
8.4216 8.4216 8.4371 8.4371 11.0192 11.0192 11.6950 11.6950
11.7000 11.7000 11.7413 11.7413 11.7671 11.7671
k = 0.3262 0.5651-0.0000 ( 4325 PWs) bands (ev):
-32.8832 -32.8832 -32.8593 -32.8593 -13.9387 -13.9387 -13.8715 -13.8715
-12.5646 -12.5646 -12.5125 -12.5125 -12.4618 -12.4618 -12.3412 -12.3412
2.1492 2.1492 2.2703 2.2703 2.3055 2.3055 2.3163 2.3163
2.4494 2.4494 2.6107 2.6107 2.6419 2.6419 2.6539 2.6539
2.6719 2.6719 2.6764 2.6764 4.3678 4.3678 4.4912 4.4912
5.1114 5.1114 5.2321 5.2321 6.0367 6.0367 8.3414 8.3414
8.4114 8.4114 8.4458 8.4458 11.0109 11.0109 11.6605 11.6605
11.7239 11.7239 11.7472 11.7472 11.7780 11.7780
k = 0.3191 0.5528-0.0000 ( 4321 PWs) bands (ev):
-32.8832 -32.8832 -32.8593 -32.8593 -13.9387 -13.9387 -13.8714 -13.8714
-12.5646 -12.5646 -12.5124 -12.5124 -12.4617 -12.4617 -12.3411 -12.3411
2.1491 2.1491 2.2694 2.2694 2.3050 2.3050 2.3169 2.3169
2.4496 2.4496 2.6102 2.6102 2.6420 2.6420 2.6539 2.6539
2.6711 2.6711 2.6772 2.6772 4.3058 4.3058 4.5388 4.5388
5.0538 5.0538 5.2965 5.2965 6.0610 6.0610 8.3330 8.3330
8.3932 8.3932 8.4618 8.4618 10.9875 10.9875 11.6233 11.6233
11.7332 11.7332 11.7593 11.7593 11.8086 11.8086
k = 0.3121 0.5405-0.0000 ( 4313 PWs) bands (ev):
-32.8832 -32.8832 -32.8593 -32.8593 -13.9387 -13.9387 -13.8713 -13.8713
-12.5646 -12.5646 -12.5122 -12.5122 -12.4615 -12.4615 -12.3411 -12.3411
2.1489 2.1489 2.2682 2.2682 2.3042 2.3042 2.3177 2.3177
2.4500 2.4500 2.6094 2.6094 2.6421 2.6421 2.6539 2.6539
2.6701 2.6701 2.6781 2.6781 4.2316 4.2316 4.5915 4.5915
4.9979 4.9979 5.3638 5.3638 6.0990 6.0990 8.3130 8.3130
8.3770 8.3770 8.4809 8.4809 10.9517 10.9517 11.5877 11.5877
11.7335 11.7335 11.7840 11.7840 11.8416 11.8416
k = 0.3050 0.5282-0.0000 ( 4309 PWs) bands (ev):
-32.8832 -32.8832 -32.8593 -32.8593 -13.9386 -13.9386 -13.8712 -13.8712
-12.5646 -12.5646 -12.5120 -12.5120 -12.4613 -12.4613 -12.3410 -12.3410
2.1486 2.1486 2.2665 2.2665 2.3033 2.3033 2.3186 2.3186
2.4505 2.4505 2.6084 2.6084 2.6422 2.6422 2.6539 2.6539
2.6689 2.6689 2.6792 2.6792 4.1491 4.1491 4.6470 4.6470
4.9439 4.9439 5.4341 5.4341 6.1488 6.1488 8.2784 8.2784
8.3669 8.3669 8.5025 8.5025 10.9063 10.9063 11.5544 11.5544
11.7317 11.7317 11.8210 11.8210 11.8775 11.8775
k = 0.2979 0.5159-0.0000 ( 4309 PWs) bands (ev):
-32.8833 -32.8833 -32.8593 -32.8593 -13.9385 -13.9385 -13.8710 -13.8710
-12.5646 -12.5646 -12.5117 -12.5117 -12.4610 -12.4610 -12.3409 -12.3409
2.1483 2.1483 2.2646 2.2646 2.3022 2.3022 2.3195 2.3195
2.4509 2.4509 2.6072 2.6072 2.6423 2.6423 2.6539 2.6539
2.6676 2.6676 2.6802 2.6802 4.0609 4.0609 4.7043 4.7043
4.8924 4.8924 5.5074 5.5074 6.2083 6.2083 8.2322 8.2322
8.3609 8.3609 8.5266 8.5266 10.8537 10.8537 11.5237 11.5237
11.7306 11.7306 11.8678 11.8678 11.9150 11.9150
k = 0.2908 0.5036-0.0000 ( 4309 PWs) bands (ev):
-32.8833 -32.8833 -32.8593 -32.8593 -13.9384 -13.9384 -13.8708 -13.8708
-12.5647 -12.5647 -12.5113 -12.5113 -12.4606 -12.4606 -12.3408 -12.3408
2.1478 2.1478 2.2624 2.2624 2.3010 2.3010 2.3202 2.3202
2.4513 2.4513 2.6057 2.6057 2.6422 2.6422 2.6539 2.6539
2.6662 2.6662 2.6811 2.6811 3.9685 3.9685 4.7597 4.7597
4.8469 4.8469 5.5837 5.5837 6.2760 6.2760 8.1774 8.1774
8.3570 8.3570 8.5529 8.5529 10.7959 10.7959 11.4957 11.4957
11.7310 11.7310 11.9223 11.9223 11.9521 11.9521
k = 0.2837 0.4914-0.0000 ( 4313 PWs) bands (ev):
-32.8833 -32.8833 -32.8594 -32.8594 -13.9383 -13.9383 -13.8706 -13.8706
-12.5647 -12.5647 -12.5108 -12.5108 -12.4602 -12.4602 -12.3407 -12.3407
2.1472 2.1472 2.2601 2.2601 2.2998 2.2998 2.3208 2.3208
2.4516 2.4516 2.6041 2.6041 2.6420 2.6420 2.6539 2.6539
2.6647 2.6647 2.6818 2.6818 3.8736 3.8736 4.7737 4.7737
4.8467 4.8467 5.6630 5.6630 6.3504 6.3504 8.1156 8.1156
8.3543 8.3543 8.5816 8.5816 10.7341 10.7341 11.4705 11.4705
11.7330 11.7330 11.9810 11.9810 11.9871 11.9871
k = 0.2766 0.4791-0.0000 ( 4305 PWs) bands (ev):
-32.8833 -32.8833 -32.8594 -32.8594 -13.9381 -13.9381 -13.8703 -13.8703
-12.5647 -12.5647 -12.5103 -12.5103 -12.4596 -12.4596 -12.3405 -12.3405
2.1465 2.1465 2.2576 2.2576 2.2985 2.2985 2.3213 2.3213
2.4518 2.4518 2.6024 2.6024 2.6416 2.6416 2.6538 2.6538
2.6633 2.6633 2.6825 2.6825 3.7772 3.7772 4.7340 4.7340
4.9045 4.9045 5.7453 5.7453 6.4304 6.4304 8.0481 8.0481
8.3529 8.3529 8.6126 8.6126 10.6696 10.6696 11.4483 11.4483
11.7369 11.7369 12.0185 12.0185 12.0399 12.0399
k = 0.2695 0.4668-0.0000 ( 4307 PWs) bands (ev):
-32.8834 -32.8834 -32.8594 -32.8594 -13.9379 -13.9379 -13.8699 -13.8699
-12.5647 -12.5647 -12.5097 -12.5097 -12.4590 -12.4590 -12.3404 -12.3404
2.1457 2.1457 2.2551 2.2551 2.2970 2.2970 2.3215 2.3215
2.4517 2.4517 2.6005 2.6005 2.6410 2.6410 2.6538 2.6538
2.6619 2.6619 2.6829 2.6829 3.6803 3.6803 4.6894 4.6894
4.9711 4.9711 5.8306 5.8306 6.5151 6.5151 7.9758 7.9758
8.3527 8.3527 8.6460 8.6460 10.6033 10.6033 11.4291 11.4291
11.7427 11.7427 12.0456 12.0456 12.0954 12.0954
k = 0.2624 0.4545-0.0000 ( 4299 PWs) bands (ev):
-32.8834 -32.8834 -32.8595 -32.8595 -13.9377 -13.9377 -13.8695 -13.8695
-12.5647 -12.5647 -12.5089 -12.5089 -12.4584 -12.4584 -12.3402 -12.3402
2.1447 2.1447 2.2526 2.2526 2.2954 2.2954 2.3215 2.3215
2.4515 2.4515 2.5986 2.5986 2.6399 2.6399 2.6537 2.6537
2.6607 2.6607 2.6831 2.6831 3.5838 3.5838 4.6454 4.6454
5.0411 5.0411 5.9189 5.9189 6.6036 6.6036 7.8994 7.8994
8.3539 8.3539 8.6817 8.6817 10.5357 10.5357 11.4129 11.4129
11.7504 11.7504 12.0671 12.0671 12.1462 12.1462
k = 0.2553 0.4422-0.0000 ( 4291 PWs) bands (ev):
-32.8835 -32.8835 -32.8595 -32.8595 -13.9375 -13.9375 -13.8691 -13.8691
-12.5647 -12.5647 -12.5081 -12.5081 -12.4577 -12.4577 -12.3400 -12.3400
2.1436 2.1436 2.2500 2.2500 2.2937 2.2937 2.3212 2.3212
2.4509 2.4509 2.5966 2.5966 2.6384 2.6384 2.6535 2.6535
2.6596 2.6596 2.6830 2.6830 3.4884 3.4884 4.6026 4.6026
5.1138 5.1138 6.0100 6.0100 6.6953 6.6953 7.8197 7.8197
8.3567 8.3567 8.7198 8.7198 10.4674 10.4674 11.3998 11.3998
11.7602 11.7602 12.0822 12.0822 12.1919 12.1919
k = 0.2482 0.4299-0.0000 ( 4297 PWs) bands (ev):
-32.8835 -32.8835 -32.8595 -32.8595 -13.9372 -13.9372 -13.8686 -13.8686
-12.5647 -12.5647 -12.5073 -12.5073 -12.4569 -12.4569 -12.3398 -12.3398
2.1423 2.1423 2.2475 2.2475 2.2917 2.2917 2.3207 2.3207
2.4500 2.4500 2.5945 2.5945 2.6362 2.6362 2.6532 2.6532
2.6589 2.6589 2.6826 2.6826 3.3948 3.3948 4.5612 4.5612
5.1891 5.1891 6.1041 6.1041 6.7895 6.7895 7.7373 7.7373
8.3612 8.3612 8.7602 8.7602 10.3989 10.3989 11.3897 11.3897
11.7719 11.7719 12.0900 12.0900 12.2317 12.2317
k = 0.2411 0.4177-0.0000 ( 4291 PWs) bands (ev):
-32.8836 -32.8836 -32.8596 -32.8596 -13.9370 -13.9370 -13.8681 -13.8681
-12.5646 -12.5646 -12.5063 -12.5063 -12.4560 -12.4560 -12.3396 -12.3396
2.1408 2.1408 2.2449 2.2449 2.2894 2.2894 2.3199 2.3199
2.4486 2.4486 2.5923 2.5923 2.6334 2.6334 2.6526 2.6526
2.6584 2.6584 2.6818 2.6818 3.3037 3.3037 4.5213 4.5213
5.2667 5.2667 6.2010 6.2010 6.8857 6.8857 7.6529 7.6529
8.3676 8.3676 8.8031 8.8031 10.3306 10.3306 11.3827 11.3827
11.7855 11.7855 12.0898 12.0898 12.2635 12.2635
k = 0.2340 0.4054-0.0000 ( 4285 PWs) bands (ev):
-32.8836 -32.8836 -32.8597 -32.8597 -13.9367 -13.9367 -13.8675 -13.8675
-12.5646 -12.5646 -12.5052 -12.5052 -12.4551 -12.4551 -12.3394 -12.3394
2.1391 2.1391 2.2423 2.2423 2.2867 2.2867 2.3189 2.3189
2.4467 2.4467 2.5902 2.5902 2.6298 2.6298 2.6519 2.6519
2.6583 2.6583 2.6808 2.6808 3.2158 3.2158 4.4830 4.4830
5.3467 5.3467 6.3007 6.3007 6.9834 6.9834 7.5669 7.5669
8.3762 8.3762 8.8484 8.8484 10.2628 10.2628 11.3789 11.3789
11.8011 11.8011 12.0809 12.0809 12.2838 12.2838
k = 0.2270 0.3931-0.0000 ( 4285 PWs) bands (ev):
-32.8837 -32.8837 -32.8597 -32.8597 -13.9364 -13.9364 -13.8669 -13.8669
-12.5646 -12.5646 -12.5041 -12.5041 -12.4541 -12.4541 -12.3391 -12.3391
2.1370 2.1370 2.2396 2.2396 2.2836 2.2836 2.3175 2.3175
2.4440 2.4440 2.5880 2.5880 2.6252 2.6252 2.6510 2.6510
2.6584 2.6584 2.6793 2.6793 3.1321 3.1321 4.4461 4.4461
5.4291 5.4291 6.4032 6.4032 7.0821 7.0821 7.4800 7.4800
8.3870 8.3870 8.8961 8.8961 10.1959 10.1959 11.3782 11.3782
11.8186 11.8186 12.0628 12.0628 12.2884 12.2884
k = 0.2199 0.3808-0.0000 ( 4277 PWs) bands (ev):
-32.8838 -32.8838 -32.8598 -32.8598 -13.9360 -13.9360 -13.8663 -13.8663
-12.5645 -12.5645 -12.5029 -12.5029 -12.4531 -12.4531 -12.3389 -12.3389
2.1347 2.1347 2.2366 2.2366 2.2799 2.2799 2.3159 2.3159
2.4404 2.4404 2.5858 2.5858 2.6195 2.6195 2.6500 2.6500
2.6585 2.6585 2.6774 2.6774 3.0537 3.0537 4.4107 4.4107
5.5137 5.5137 6.5084 6.5084 7.1814 7.1814 7.3925 7.3925
8.4001 8.4001 8.9462 8.9462 10.1300 10.1300 11.3806 11.3806
11.8378 11.8378 12.0360 12.0360 12.2739 12.2739
k = 0.2128 0.3685-0.0000 ( 4281 PWs) bands (ev):
-32.8839 -32.8839 -32.8598 -32.8598 -13.9356 -13.9356 -13.8656 -13.8656
-12.5644 -12.5644 -12.5016 -12.5016 -12.4520 -12.4520 -12.3386 -12.3386
2.1318 2.1318 2.2332 2.2332 2.2755 2.2755 2.3139 2.3139
2.4356 2.4356 2.5836 2.5836 2.6124 2.6124 2.6489 2.6489
2.6585 2.6585 2.6752 2.6752 2.9819 2.9819 4.3768 4.3768
5.6007 5.6007 6.6162 6.6162 7.2795 7.2795 7.3061 7.3061
8.4157 8.4157 8.9988 8.9988 10.0655 10.0655 11.3861 11.3861
11.8587 11.8587 12.0017 12.0017 12.2413 12.2413
k = 0.2057 0.3562-0.0000 ( 4283 PWs) bands (ev):
-32.8839 -32.8839 -32.8599 -32.8599 -13.9353 -13.9353 -13.8649 -13.8649
-12.5644 -12.5644 -12.5002 -12.5002 -12.4508 -12.4508 -12.3384 -12.3384
2.1282 2.1282 2.2288 2.2288 2.2704 2.2704 2.3117 2.3117
2.4292 2.4292 2.5811 2.5811 2.6037 2.6037 2.6476 2.6476
2.6583 2.6583 2.6728 2.6728 2.9183 2.9183 4.3442 4.3442
5.6899 5.6899 6.7266 6.7266 7.2168 7.2168 7.3803 7.3803
8.4339 8.4339 9.0537 9.0537 10.0026 10.0026 11.3948 11.3948
11.8809 11.8809 11.9619 11.9619 12.1950 12.1950
k = 0.1986 0.3440-0.0000 ( 4285 PWs) bands (ev):
-32.8840 -32.8840 -32.8600 -32.8600 -13.9349 -13.9349 -13.8641 -13.8641
-12.5643 -12.5643 -12.4988 -12.4988 -12.4497 -12.4497 -12.3381 -12.3381
2.1235 2.1235 2.2227 2.2227 2.2647 2.2647 2.3091 2.3091
2.4211 2.4211 2.5781 2.5781 2.5938 2.5938 2.6462 2.6462
2.6575 2.6575 2.6707 2.6707 2.8644 2.8644 4.3131 4.3131
5.7814 5.7814 6.8395 6.8395 7.1298 7.1298 7.4783 7.4783
8.4548 8.4548 9.1111 9.1111 9.9417 9.9417 11.4066 11.4066
11.8992 11.8992 11.9233 11.9233 12.1399 12.1399
k = 0.1915 0.3317-0.0000 ( 4285 PWs) bands (ev):
-32.8841 -32.8841 -32.8600 -32.8600 -13.9345 -13.9345 -13.8633 -13.8633
-12.5642 -12.5642 -12.4973 -12.4973 -12.4485 -12.4485 -12.3378 -12.3378
2.1169 2.1169 2.2139 2.2139 2.2591 2.2591 2.3062 2.3062
2.4112 2.4112 2.5724 2.5724 2.5849 2.5849 2.6445 2.6445
2.6556 2.6556 2.6692 2.6692 2.8213 2.8213 4.2833 4.2833
5.8750 5.8750 6.9547 6.9547 7.0437 7.0437 7.5750 7.5750
8.4785 8.4785 9.1709 9.1709 9.8829 9.8829 11.4215 11.4215
11.8669 11.8669 11.9346 11.9346 12.0797 12.0797
k = 0.1844 0.3194-0.0000 ( 4287 PWs) bands (ev):
-32.8842 -32.8842 -32.8601 -32.8601 -13.9340 -13.9340 -13.8625 -13.8625
-12.5641 -12.5641 -12.4958 -12.4958 -12.4472 -12.4472 -12.3375 -12.3375
2.1067 2.1067 2.2018 2.2018 2.2542 2.2542 2.3031 2.3031
2.4000 2.4000 2.5623 2.5623 2.5800 2.5800 2.6425 2.6425
2.6529 2.6529 2.6687 2.6687 2.7888 2.7888 4.2549 4.2549
5.9708 5.9708 6.9585 6.9585 7.0722 7.0722 7.6699 7.6699
8.5049 8.5049 9.2330 9.2330 9.8267 9.8267 11.4395 11.4395
11.8199 11.8199 11.9605 11.9605 12.0171 12.0171
k = 0.1773 0.3071-0.0000 ( 4297 PWs) bands (ev):
-32.8843 -32.8843 -32.8602 -32.8602 -13.9336 -13.9336 -13.8617 -13.8617
-12.5640 -12.5640 -12.4942 -12.4942 -12.4460 -12.4460 -12.3373 -12.3373
2.0906 2.0906 2.1877 2.1877 2.2504 2.2504 2.2997 2.2997
2.3884 2.3884 2.5508 2.5508 2.5774 2.5774 2.6400 2.6400
2.6498 2.6498 2.6689 2.6689 2.7652 2.7652 4.2278 4.2278
6.0688 6.0688 6.8748 6.8748 7.1919 7.1919 7.7622 7.7622
8.5342 8.5342 9.2974 9.2974 9.7732 9.7732 11.4605 11.4605
11.7721 11.7721 11.9517 11.9517 11.9899 11.9899
k = 0.1702 0.2948-0.0000 ( 4293 PWs) bands (ev):
-32.8844 -32.8844 -32.8603 -32.8603 -13.9332 -13.9332 -13.8608 -13.8608
-12.5638 -12.5638 -12.4926 -12.4926 -12.4447 -12.4447 -12.3370 -12.3370
2.0656 2.0656 2.1745 2.1745 2.2477 2.2477 2.2963 2.2963
2.3776 2.3776 2.5407 2.5407 2.5755 2.5755 2.6369 2.6369
2.6470 2.6470 2.6695 2.6695 2.7483 2.7483 4.2019 4.2019
6.1688 6.1688 6.7927 6.7927 7.3136 7.3136 7.8513 7.8513
8.5664 8.5664 9.3642 9.3642 9.7229 9.7229 11.4844 11.4844
11.7249 11.7249 11.8885 11.8885 12.0181 12.0181
k = 0.1631 0.2825-0.0000 ( 4297 PWs) bands (ev):
-32.8845 -32.8845 -32.8604 -32.8604 -13.9327 -13.9327 -13.8600 -13.8600
-12.5637 -12.5637 -12.4910 -12.4910 -12.4433 -12.4433 -12.3367 -12.3367
2.0309 2.0309 2.1645 2.1645 2.2458 2.2458 2.2926 2.2926
2.3682 2.3682 2.5324 2.5324 2.5740 2.5740 2.6332 2.6332
2.6446 2.6446 2.6704 2.6704 2.7362 2.7362 4.1773 4.1773
6.2708 6.2708 6.7123 6.7123 7.4372 7.4372 7.9366 7.9366
8.6015 8.6015 9.4331 9.4331 9.6760 9.6760 11.5112 11.5112
11.6787 11.6787 11.8254 11.8254 12.0473 12.0473
k = 0.1560 0.2702-0.0000 ( 4281 PWs) bands (ev):
-32.8846 -32.8846 -32.8604 -32.8604 -13.9323 -13.9323 -13.8591 -13.8591
-12.5636 -12.5636 -12.4893 -12.4893 -12.4420 -12.4420 -12.3364 -12.3364
1.9884 1.9884 2.1577 2.1577 2.2445 2.2445 2.2889 2.2889
2.3604 2.3604 2.5261 2.5261 2.5727 2.5727 2.6293 2.6293
2.6426 2.6426 2.6715 2.6715 2.7271 2.7271 4.1540 4.1540
6.3748 6.3748 6.6340 6.6340 7.5625 7.5625 8.0174 8.0174
8.6395 8.6395 9.5042 9.5042 9.6330 9.6330 11.5404 11.5404
11.6343 11.6343 11.7636 11.7636 12.0764 12.0764
k = 0.1489 0.2580-0.0000 ( 4281 PWs) bands (ev):
-32.8847 -32.8847 -32.8605 -32.8605 -13.9318 -13.9318 -13.8582 -13.8582
-12.5634 -12.5634 -12.4877 -12.4877 -12.4407 -12.4407 -12.3361 -12.3361
1.9408 1.9408 2.1531 2.1531 2.2435 2.2435 2.2851 2.2851
2.3539 2.3539 2.5213 2.5213 2.5716 2.5716 2.6251 2.6251
2.6407 2.6407 2.6727 2.6727 2.7202 2.7202 4.1318 4.1318
6.4804 6.4804 6.5581 6.5581 7.6894 7.6894 8.0930 8.0930
8.6805 8.6805 9.5769 9.5769 9.5947 9.5947 11.5676 11.5676
11.5965 11.5965 11.7035 11.7035 12.1044 12.1044
k = 0.1418 0.2457-0.0000 ( 4269 PWs) bands (ev):
-32.8847 -32.8847 -32.8606 -32.8606 -13.9314 -13.9314 -13.8573 -13.8573
-12.5633 -12.5633 -12.4860 -12.4860 -12.4393 -12.4393 -12.3358 -12.3358
1.8905 1.8905 2.1500 2.1500 2.2429 2.2429 2.2812 2.2812
2.3487 2.3487 2.5177 2.5177 2.5706 2.5706 2.6210 2.6210
2.6390 2.6390 2.6740 2.6740 2.7146 2.7146 4.1108 4.1108
6.4837 6.4837 6.5885 6.5885 7.8175 7.8175 8.1627 8.1627
8.7243 8.7243 9.5596 9.5596 9.6530 9.6530 11.5451 11.5451
11.6122 11.6122 11.6459 11.6459 12.1302 12.1302
k = 0.1348 0.2334-0.0000 ( 4265 PWs) bands (ev):
-32.8848 -32.8848 -32.8607 -32.8607 -13.9309 -13.9309 -13.8565 -13.8565
-12.5632 -12.5632 -12.4843 -12.4843 -12.4380 -12.4380 -12.3355 -12.3355
1.8391 1.8391 2.1479 2.1479 2.2424 2.2424 2.2772 2.2772
2.3443 2.3443 2.5150 2.5150 2.5698 2.5698 2.6169 2.6169
2.6374 2.6374 2.6753 2.6753 2.7100 2.7100 4.0910 4.0910
6.4126 6.4126 6.6976 6.6976 7.9467 7.9467 8.2259 8.2259
8.7709 8.7709 9.5302 9.5302 9.7301 9.7301 11.5068 11.5068
11.5880 11.5880 11.6509 11.6509 12.1529 12.1529
k = 0.1277 0.2211-0.0000 ( 4269 PWs) bands (ev):
-32.8849 -32.8849 -32.8608 -32.8608 -13.9305 -13.9305 -13.8556 -13.8556
-12.5630 -12.5630 -12.4827 -12.4827 -12.4367 -12.4367 -12.3352 -12.3352
1.7878 1.7878 2.1466 2.1466 2.2421 2.2421 2.2731 2.2731
2.3405 2.3405 2.5130 2.5130 2.5691 2.5691 2.6128 2.6128
2.6357 2.6357 2.6767 2.6767 2.7061 2.7061 4.0723 4.0723
6.3441 6.3441 6.8084 6.8084 8.0766 8.0766 8.2819 8.2819
8.8203 8.8203 9.5060 9.5060 9.8091 9.8091 11.4697 11.4697
11.5344 11.5344 11.6912 11.6912 12.1728 12.1728
k = 0.1206 0.2088-0.0000 ( 4253 PWs) bands (ev):
-32.8850 -32.8850 -32.8608 -32.8608 -13.9300 -13.9300 -13.8548 -13.8548
-12.5629 -12.5629 -12.4810 -12.4810 -12.4354 -12.4354 -12.3349 -12.3349
1.7374 1.7374 2.1459 2.1459 2.2419 2.2419 2.2690 2.2690
2.3373 2.3373 2.5117 2.5117 2.5686 2.5686 2.6089 2.6089
2.6342 2.6342 2.6781 2.6781 2.7028 2.7028 4.0547 4.0547
6.2784 6.2784 6.9204 6.9204 8.2068 8.2068 8.3306 8.3306
8.8724 8.8724 9.4871 9.4871 9.8897 9.8897 11.4346 11.4346
11.4831 11.4831 11.7343 11.7343 12.1907 12.1907
k = 0.1135 0.1965-0.0000 ( 4253 PWs) bands (ev):
-32.8851 -32.8851 -32.8609 -32.8609 -13.9296 -13.9296 -13.8539 -13.8539
-12.5628 -12.5628 -12.4795 -12.4795 -12.4341 -12.4341 -12.3346 -12.3346
1.6884 1.6884 2.1456 2.1456 2.2417 2.2417 2.2648 2.2648
2.3345 2.3345 2.5107 2.5107 2.5681 2.5681 2.6050 2.6050
2.6326 2.6326 2.6795 2.6795 2.6999 2.6999 4.0382 4.0382
6.2156 6.2156 7.0336 7.0336 8.3350 8.3350 8.3735 8.3735
8.9270 8.9270 9.4735 9.4735 9.9717 9.9717 11.4016 11.4016
11.4345 11.4345 11.7798 11.7798 12.2045 12.2045
k = 0.1064 0.1843-0.0000 ( 4253 PWs) bands (ev):
-32.8852 -32.8852 -32.8610 -32.8610 -13.9292 -13.9292 -13.8531 -13.8531
-12.5627 -12.5627 -12.4779 -12.4779 -12.4329 -12.4329 -12.3343 -12.3343
1.6414 1.6414 2.1457 2.1457 2.2415 2.2415 2.2605 2.2605
2.3319 2.3319 2.5101 2.5101 2.5678 2.5678 2.6012 2.6012
2.6311 2.6311 2.6808 2.6808 2.6973 2.6973 4.0228 4.0228
6.1560 6.1560 7.1478 7.1478 8.4014 8.4014 8.4702 8.4702
8.9840 8.9840 9.4649 9.4649 10.0550 10.0550 11.3704 11.3704
11.3893 11.3893 11.8275 11.8275 12.2051 12.2051
k = 0.0993 0.1720-0.0000 ( 4241 PWs) bands (ev):
-32.8853 -32.8853 -32.8611 -32.8611 -13.9288 -13.9288 -13.8524 -13.8524
-12.5625 -12.5625 -12.4764 -12.4764 -12.4316 -12.4316 -12.3340 -12.3340
1.5965 1.5965 2.1463 2.1463 2.2412 2.2412 2.2563 2.2563
2.3296 2.3296 2.5098 2.5098 2.5675 2.5675 2.5976 2.5976
2.6296 2.6296 2.6820 2.6820 2.6952 2.6952 4.0085 4.0085
6.0995 6.0995 7.2625 7.2625 8.4279 8.4279 8.5985 8.5985
9.0433 9.0433 9.4609 9.4609 10.1393 10.1393 11.3377 11.3377
11.3509 11.3509 11.8769 11.8769 12.1787 12.1787
k = 0.0922 0.1597-0.0000 ( 4241 PWs) bands (ev):
-32.8854 -32.8854 -32.8611 -32.8611 -13.9284 -13.9284 -13.8516 -13.8516
-12.5624 -12.5624 -12.4750 -12.4750 -12.4305 -12.4305 -12.3338 -12.3338
1.5541 1.5541 2.1472 2.1472 2.2406 2.2406 2.2523 2.2523
2.3276 2.3276 2.5097 2.5097 2.5674 2.5674 2.5941 2.5941
2.6282 2.6282 2.6829 2.6829 2.6936 2.6936 3.9952 3.9952
6.0465 6.0465 7.3774 7.3774 8.4469 8.4469 8.7260 8.7260
9.1047 9.1047 9.4609 9.4609 10.2243 10.2243 11.3000 11.3000
11.3230 11.3230 11.9276 11.9276 12.1180 12.1180
k = 0.0851 0.1474-0.0000 ( 4235 PWs) bands (ev):
-32.8854 -32.8854 -32.8612 -32.8612 -13.9281 -13.9281 -13.8509 -13.8509
-12.5623 -12.5623 -12.4736 -12.4736 -12.4294 -12.4294 -12.3335 -12.3335
1.5143 1.5143 2.1485 2.1485 2.2393 2.2393 2.2490 2.2490
2.3257 2.3257 2.5098 2.5098 2.5673 2.5673 2.5908 2.5908
2.6268 2.6268 2.6833 2.6833 2.6926 2.6926 3.9830 3.9830
5.9968 5.9968 7.4922 7.4922 8.4599 8.4599 8.8515 8.8515
9.1678 9.1678 9.4640 9.4640 10.3097 10.3097 11.2628 11.2628
11.3005 11.3005 11.9767 11.9767 12.0282 12.0282
k = 0.0780 0.1351-0.0000 ( 4241 PWs) bands (ev):
-32.8855 -32.8855 -32.8613 -32.8613 -13.9277 -13.9277 -13.8502 -13.8502
-12.5622 -12.5622 -12.4723 -12.4723 -12.4284 -12.4284 -12.3333 -12.3333
1.4773 1.4773 2.1500 2.1500 2.2368 2.2368 2.2469 2.2469
2.3240 2.3240 2.5100 2.5100 2.5672 2.5672 2.5877 2.5877
2.6255 2.6255 2.6831 2.6831 2.6924 2.6924 3.9717 3.9717
5.9508 5.9508 7.6062 7.6062 8.4679 8.4679 8.9739 8.9739
9.2323 9.2323 9.4695 9.4695 10.3949 10.3949 11.2280 11.2280
11.2814 11.2814 11.9089 11.9089 12.0328 12.0328
k = 0.0709 0.1228-0.0000 ( 4249 PWs) bands (ev):
-32.8856 -32.8856 -32.8613 -32.8613 -13.9274 -13.9274 -13.8496 -13.8496
-12.5621 -12.5621 -12.4711 -12.4711 -12.4274 -12.4274 -12.3331 -12.3331
1.4433 1.4433 2.1519 2.1519 2.2332 2.2332 2.2458 2.2458
2.3225 2.3225 2.5103 2.5103 2.5671 2.5671 2.5847 2.5847
2.6242 2.6242 2.6824 2.6824 2.6928 2.6928 3.9615 3.9615
5.9084 5.9084 7.7188 7.7188 8.4720 8.4720 9.0924 9.0924
9.2978 9.2978 9.4765 9.4765 10.4794 10.4794 11.1959 11.1959
11.2656 11.2656 11.7844 11.7844 11.9957 11.9957
k = 0.0638 0.1106-0.0000 ( 4241 PWs) bands (ev):
-32.8856 -32.8856 -32.8614 -32.8614 -13.9271 -13.9271 -13.8490 -13.8490
-12.5621 -12.5621 -12.4700 -12.4700 -12.4265 -12.4265 -12.3329 -12.3329
1.4122 1.4122 2.1541 2.1541 2.2288 2.2288 2.2454 2.2454
2.3211 2.3211 2.5106 2.5106 2.5672 2.5672 2.5820 2.5820
2.6231 2.6231 2.6815 2.6815 2.6935 2.6935 3.9523 3.9523
5.8697 5.8697 7.8290 7.8290 8.4730 8.4730 9.2057 9.2057
9.3637 9.3637 9.4843 9.4843 10.5625 10.5625 11.1669 11.1669
11.2531 11.2531 11.6553 11.6553 11.8794 11.8794
k = 0.0567 0.0983-0.0000 ( 4233 PWs) bands (ev):
-32.8857 -32.8857 -32.8614 -32.8614 -13.9269 -13.9269 -13.8485 -13.8485
-12.5620 -12.5620 -12.4690 -12.4690 -12.4257 -12.4257 -12.3327 -12.3327
1.3842 1.3842 2.1565 2.1565 2.2243 2.2243 2.2453 2.2453
2.3199 2.3199 2.5110 2.5110 2.5673 2.5673 2.5795 2.5795
2.6220 2.6220 2.6804 2.6804 2.6945 2.6945 3.9441 3.9441
5.8349 5.8349 7.9360 7.9360 8.4718 8.4718 9.3127 9.3127
9.4293 9.4293 9.4924 9.4924 10.6434 10.6434 11.1408 11.1408
11.2437 11.2437 11.5269 11.5269 11.7671 11.7671
k = 0.0496 0.0860-0.0000 ( 4231 PWs) bands (ev):
-32.8857 -32.8857 -32.8615 -32.8615 -13.9266 -13.9266 -13.8480 -13.8480
-12.5619 -12.5619 -12.4681 -12.4681 -12.4249 -12.4249 -12.3325 -12.3325
1.3594 1.3594 2.1592 2.1592 2.2196 2.2196 2.2453 2.2453
2.3188 2.3188 2.5115 2.5115 2.5674 2.5674 2.5773 2.5773
2.6210 2.6210 2.6794 2.6794 2.6954 2.6954 3.9369 3.9369
5.8040 5.8040 8.0382 8.0382 8.4692 8.4692 9.4119 9.4119
9.4936 9.4936 9.5002 9.5002 10.7210 10.7210 11.1178 11.1178
11.2374 11.2374 11.4029 11.4029 11.6615 11.6615
k = 0.0426 0.0737-0.0000 ( 4233 PWs) bands (ev):
-32.8858 -32.8858 -32.8615 -32.8615 -13.9264 -13.9264 -13.8476 -13.8476
-12.5619 -12.5619 -12.4673 -12.4673 -12.4243 -12.4243 -12.3323 -12.3323
1.3378 1.3378 2.1621 2.1621 2.2148 2.2148 2.2453 2.2453
2.3178 2.3178 2.5119 2.5119 2.5675 2.5675 2.5753 2.5753
2.6201 2.6201 2.6784 2.6784 2.6964 2.6964 3.9306 3.9306
5.7771 5.7771 8.1341 8.1341 8.4659 8.4659 9.5019 9.5019
9.5073 9.5073 9.5558 9.5558 10.7940 10.7940 11.0980 11.0980
11.2338 11.2338 11.2864 11.2864 11.5639 11.5639
k = 0.0355 0.0614-0.0000 ( 4239 PWs) bands (ev):
-32.8858 -32.8858 -32.8615 -32.8615 -13.9263 -13.9263 -13.8473 -13.8473
-12.5618 -12.5618 -12.4666 -12.4666 -12.4237 -12.4237 -12.3322 -12.3322
1.3194 1.3194 2.1653 2.1653 2.2101 2.2101 2.2454 2.2454
2.3170 2.3170 2.5122 2.5122 2.5675 2.5675 2.5736 2.5736
2.6193 2.6193 2.6776 2.6776 2.6972 2.6972 3.9253 3.9253
5.7542 5.7542 8.2218 8.2218 8.4622 8.4622 9.5136 9.5136
9.5809 9.5809 9.6143 9.6143 10.8606 10.8606 11.0815 11.0815
11.1803 11.1803 11.2324 11.2324 11.4762 11.4762
k = 0.0284 0.0491-0.0000 ( 4237 PWs) bands (ev):
-32.8859 -32.8859 -32.8616 -32.8616 -13.9261 -13.9261 -13.8470 -13.8470
-12.5618 -12.5618 -12.4661 -12.4661 -12.4233 -12.4233 -12.3321 -12.3321
1.3043 1.3043 2.1686 2.1686 2.2055 2.2055 2.2454 2.2454
2.3163 2.3163 2.5126 2.5126 2.5676 2.5676 2.5722 2.5722
2.6187 2.6187 2.6769 2.6769 2.6979 2.6979 3.9210 3.9210
5.7354 5.7354 8.2989 8.2989 8.4588 8.4588 9.5189 9.5189
9.6471 9.6471 9.6678 9.6678 10.9189 10.9189 11.0686 11.0686
11.0875 11.0875 11.2321 11.2321 11.4005 11.4005
k = 0.0213 0.0369-0.0000 ( 4229 PWs) bands (ev):
-32.8859 -32.8859 -32.8616 -32.8616 -13.9260 -13.9260 -13.8467 -13.8467
-12.5617 -12.5617 -12.4656 -12.4656 -12.4229 -12.4229 -12.3320 -12.3320
1.2926 1.2926 2.1720 2.1720 2.2011 2.2011 2.2455 2.2455
2.3158 2.3158 2.5129 2.5129 2.5677 2.5677 2.5712 2.5712
2.6182 2.6182 2.6764 2.6764 2.6985 2.6985 3.9177 3.9177
5.7207 5.7207 8.3628 8.3628 8.4558 8.4558 9.5231 9.5231
9.6987 9.6987 9.7145 9.7145 10.9661 10.9661 11.0110 11.0110
11.0600 11.0600 11.2311 11.2311 11.3401 11.3401
k = 0.0142 0.0246-0.0000 ( 4227 PWs) bands (ev):
-32.8859 -32.8859 -32.8616 -32.8616 -13.9259 -13.9259 -13.8466 -13.8466
-12.5617 -12.5617 -12.4653 -12.4653 -12.4226 -12.4226 -12.3319 -12.3319
1.2842 1.2842 2.1753 2.1753 2.1970 2.1970 2.2456 2.2456
2.3155 2.3155 2.5131 2.5131 2.5677 2.5677 2.5704 2.5704
2.6178 2.6178 2.6760 2.6760 2.6990 2.6990 3.9153 3.9153
5.7102 5.7102 8.4107 8.4107 8.4537 8.4537 9.5261 9.5261
9.7354 9.7354 9.7513 9.7513 10.9537 10.9537 10.9988 10.9988
11.0570 11.0570 11.2265 11.2265 11.2993 11.2993
k = 0.0071 0.0123-0.0000 ( 4231 PWs) bands (ev):
-32.8859 -32.8859 -32.8616 -32.8616 -13.9259 -13.9259 -13.8465 -13.8465
-12.5617 -12.5617 -12.4651 -12.4651 -12.4225 -12.4225 -12.3319 -12.3319
1.2791 1.2791 2.1781 2.1781 2.1938 2.1938 2.2456 2.2456
2.3152 2.3152 2.5132 2.5132 2.5677 2.5677 2.5700 2.5700
2.6176 2.6176 2.6757 2.6757 2.6992 2.6992 3.9139 3.9139
5.7039 5.7039 8.4397 8.4397 8.4534 8.4534 9.5279 9.5279
9.7577 9.7577 9.7746 9.7746 10.9181 10.9181 11.0144 11.0144
11.0601 11.0601 11.2180 11.2180 11.2798 11.2798
k = 0.0000 0.0000 0.0000 ( 4235 PWs) bands (ev):
-32.8859 -32.8859 -32.8616 -32.8616 -13.9259 -13.9259 -13.8464 -13.8464
-12.5617 -12.5617 -12.4650 -12.4650 -12.4224 -12.4224 -12.3319 -12.3319
1.2774 1.2774 2.1794 2.1794 2.1923 2.1923 2.2456 2.2456
2.3152 2.3152 2.5132 2.5132 2.5677 2.5677 2.5698 2.5698
2.6175 2.6175 2.6756 2.6756 2.6993 2.6993 3.9134 3.9134
5.7018 5.7018 8.4471 8.4471 8.4557 8.4557 9.5286 9.5286
9.7652 9.7652 9.7825 9.7825 10.9060 10.9060 11.0181 11.0181
11.0628 11.0628 11.2134 11.2134 11.2750 11.2750
k = 0.0000 0.0000 0.0000 ( 4235 PWs) bands (ev):
-32.8859 -32.8859 -32.8616 -32.8616 -13.9259 -13.9259 -13.8464 -13.8464
-12.5617 -12.5617 -12.4650 -12.4650 -12.4224 -12.4224 -12.3319 -12.3319
1.2774 1.2774 2.1794 2.1794 2.1923 2.1923 2.2456 2.2456
2.3152 2.3152 2.5132 2.5132 2.5677 2.5677 2.5698 2.5698
2.6175 2.6175 2.6756 2.6756 2.6993 2.6993 3.9134 3.9134
5.7018 5.7018 8.4471 8.4471 8.4557 8.4557 9.5286 9.5286
9.7652 9.7652 9.7825 9.7825 10.9060 10.9060 11.0181 11.0181
11.0628 11.0628 11.2134 11.2134 11.2750 11.2750
k = 0.0000 0.0000 0.0137 ( 4235 PWs) bands (ev):
-32.8859 -32.8859 -32.8617 -32.8617 -13.9258 -13.9258 -13.8465 -13.8465
-12.5615 -12.5615 -12.4650 -12.4650 -12.4225 -12.4225 -12.3322 -12.3322
1.2788 1.2788 2.1791 2.1791 2.1924 2.1924 2.2455 2.2455
2.3153 2.3153 2.5133 2.5133 2.5676 2.5676 2.5696 2.5696
2.6176 2.6176 2.6758 2.6758 2.6992 2.6992 3.9061 3.9061
5.7116 5.7116 8.4484 8.4484 8.4571 8.4571 9.5281 9.5281
9.7668 9.7668 9.7842 9.7842 10.9072 10.9072 10.9789 10.9789
11.0066 11.0066 11.2711 11.2711 11.3157 11.3157
k = 0.0000 0.0000 0.0273 ( 4241 PWs) bands (ev):
-32.8858 -32.8858 -32.8618 -32.8618 -13.9254 -13.9254 -13.8467 -13.8467
-12.5608 -12.5608 -12.4649 -12.4649 -12.4226 -12.4226 -12.3331 -12.3331
1.2831 1.2831 2.1784 2.1784 2.1926 2.1926 2.2453 2.2453
2.3156 2.3156 2.5135 2.5135 2.5674 2.5674 2.5689 2.5689
2.6179 2.6179 2.6762 2.6762 2.6988 2.6988 3.8846 3.8846
5.7403 5.7403 8.4525 8.4525 8.4612 8.4612 9.5265 9.5265
9.7717 9.7717 9.7892 9.7892 10.8969 10.8969 10.9108 10.9108
10.9110 10.9110 11.3710 11.3710 11.4024 11.4024
k = 0.0000 0.0000 0.0410 ( 4241 PWs) bands (ev):
-32.8857 -32.8857 -32.8619 -32.8619 -13.9249 -13.9249 -13.8471 -13.8471
-12.5596 -12.5596 -12.4646 -12.4646 -12.4229 -12.4229 -12.3346 -12.3346
1.2901 1.2901 2.1771 2.1771 2.1929 2.1929 2.2450 2.2450
2.3162 2.3162 2.5138 2.5138 2.5671 2.5671 2.5678 2.5678
2.6183 2.6183 2.6768 2.6768 2.6983 2.6983 3.8503 3.8503
5.7867 5.7867 8.4594 8.4594 8.4680 8.4680 9.5236 9.5236
9.7798 9.7798 9.7975 9.7975 10.8030 10.8030 10.8104 10.8104
10.9168 10.9168 11.4786 11.4786 11.5040 11.5040
k = 0.0000 0.0000 0.0547 ( 4229 PWs) bands (ev):
-32.8855 -32.8855 -32.8621 -32.8621 -13.9241 -13.9241 -13.8476 -13.8476
-12.5580 -12.5580 -12.4643 -12.4643 -12.4232 -12.4232 -12.3367 -12.3367
1.3000 1.3000 2.1754 2.1754 2.1934 2.1934 2.2446 2.2446
2.3171 2.3171 2.5142 2.5142 2.5663 2.5663 2.5667 2.5667
2.6190 2.6190 2.6776 2.6776 2.6977 2.6977 3.8052 3.8052
5.8488 5.8488 8.4690 8.4690 8.4776 8.4776 9.5190 9.5190
9.7912 9.7912 9.8093 9.8093 10.7059 10.7059 10.7095 10.7095
10.9253 10.9253 11.5883 11.5883 11.6112 11.6112
k = 0.0000 0.0000 0.0683 ( 4235 PWs) bands (ev):
-32.8852 -32.8852 -32.8623 -32.8623 -13.9231 -13.9231 -13.8483 -13.8483
-12.5560 -12.5560 -12.4638 -12.4638 -12.4237 -12.4237 -12.3394 -12.3394
1.3126 1.3126 2.1730 2.1730 2.1939 2.1939 2.2441 2.2441
2.3182 2.3182 2.5147 2.5147 2.5642 2.5642 2.5662 2.5662
2.6198 2.6198 2.6787 2.6787 2.6967 2.6967 3.7514 3.7514
5.9245 5.9245 8.4813 8.4813 8.4899 8.4899 9.5121 9.5121
9.8058 9.8058 9.8243 9.8243 10.6086 10.6086 10.6098 10.6098
10.9361 10.9361 11.6973 11.6973 11.7206 11.7206
k = 0.0000 0.0000 0.0820 ( 4247 PWs) bands (ev):
-32.8849 -32.8849 -32.8626 -32.8626 -13.9219 -13.9219 -13.8491 -13.8491
-12.5534 -12.5534 -12.4633 -12.4633 -12.4242 -12.4242 -12.3426 -12.3426
1.3279 1.3279 2.1701 2.1701 2.1946 2.1946 2.2434 2.2434
2.3195 2.3195 2.5154 2.5154 2.5617 2.5617 2.5655 2.5655
2.6208 2.6208 2.6800 2.6800 2.6956 2.6956 3.6911 3.6911
6.0118 6.0118 8.4963 8.4963 8.5049 8.5049 9.5021 9.5021
9.8236 9.8236 9.8426 9.8426 10.5115 10.5115 10.5120 10.5120
10.9493 10.9493 11.8008 11.8008 11.8287 11.8287
k = 0.0000 0.0000 0.0957 ( 4247 PWs) bands (ev):
-32.8846 -32.8846 -32.8630 -32.8630 -13.9204 -13.9204 -13.8500 -13.8500
-12.5505 -12.5505 -12.4627 -12.4627 -12.4248 -12.4248 -12.3464 -12.3464
1.3459 1.3459 2.1665 2.1665 2.1954 2.1954 2.2426 2.2426
2.3211 2.3211 2.5160 2.5160 2.5587 2.5587 2.5647 2.5647
2.6219 2.6219 2.6817 2.6817 2.6944 2.6944 3.6260 3.6260
6.1088 6.1088 8.5140 8.5140 8.5226 8.5226 9.4881 9.4881
9.8447 9.8447 9.8642 9.8642 10.4149 10.4149 10.4167 10.4167
10.9649 10.9649 11.8816 11.8816 11.9260 11.9260
k = 0.0000 0.0000 0.1094 ( 4247 PWs) bands (ev):
-32.8842 -32.8842 -32.8634 -32.8634 -13.9189 -13.9189 -13.8511 -13.8511
-12.5471 -12.5471 -12.4620 -12.4620 -12.4256 -12.4256 -12.3507 -12.3507
1.3665 1.3665 2.1622 2.1622 2.1963 2.1963 2.2418 2.2418
2.3229 2.3229 2.5168 2.5168 2.5550 2.5550 2.5639 2.5639
2.6232 2.6232 2.6836 2.6836 2.6930 2.6930 3.5580 3.5580
6.2138 6.2138 8.5345 8.5345 8.5430 8.5430 9.4692 9.4692
9.8690 9.8690 9.8891 9.8891 10.3202 10.3202 10.3230 10.3230
10.9830 10.9830 11.8912 11.8912 11.9713 11.9713
k = 0.0000 0.0000 0.1230 ( 4247 PWs) bands (ev):
-32.8837 -32.8837 -32.8639 -32.8639 -13.9171 -13.9171 -13.8523 -13.8523
-12.5433 -12.5433 -12.4612 -12.4612 -12.4264 -12.4264 -12.3555 -12.3555
1.3896 1.3896 2.1569 2.1569 2.1973 2.1973 2.2408 2.2408
2.3251 2.3251 2.5177 2.5177 2.5508 2.5508 2.5629 2.5629
2.6247 2.6247 2.6859 2.6859 2.6914 2.6914 3.4884 3.4884
6.3257 6.3257 8.5576 8.5576 8.5661 8.5661 9.4443 9.4443
9.8965 9.8965 9.9173 9.9173 10.2274 10.2274 10.2310 10.2310
11.0033 11.0033 11.8283 11.8283 11.9182 11.9182
k = 0.0000 0.0000 0.1367 ( 4235 PWs) bands (ev):
-32.8832 -32.8832 -32.8644 -32.8644 -13.9151 -13.9151 -13.8536 -13.8536
-12.5391 -12.5391 -12.4603 -12.4603 -12.4272 -12.4272 -12.3608 -12.3608
1.4152 1.4152 2.1507 2.1507 2.1985 2.1985 2.2397 2.2397
2.3276 2.3276 2.5186 2.5186 2.5461 2.5461 2.5618 2.5618
2.6263 2.6263 2.6885 2.6885 2.6896 2.6896 3.4183 3.4183
6.4434 6.4434 8.5834 8.5834 8.5919 8.5919 9.4121 9.4121
9.9272 9.9272 9.9486 9.9486 10.1367 10.1367 10.1411 10.1411
11.0261 11.0261 11.7409 11.7409 11.8259 11.8259
k = 0.0000 0.0000 0.1504 ( 4253 PWs) bands (ev):
-32.8827 -32.8827 -32.8649 -32.8649 -13.9131 -13.9131 -13.8551 -13.8551
-12.5344 -12.5344 -12.4594 -12.4594 -12.4282 -12.4282 -12.3665 -12.3665
1.4431 1.4431 2.1433 2.1433 2.1997 2.1997 2.2386 2.2386
2.3304 2.3304 2.5193 2.5193 2.5407 2.5407 2.5607 2.5607
2.6280 2.6280 2.6876 2.6876 2.6915 2.6915 3.3489 3.3489
6.5658 6.5658 8.6119 8.6119 8.6203 8.6203 9.3716 9.3716
9.9610 9.9610 9.9823 9.9823 10.0479 10.0479 10.0541 10.0541
11.0512 11.0512 11.6468 11.6468 11.7259 11.7259
k = 0.0000 0.0000 0.1640 ( 4253 PWs) bands (ev):
-32.8821 -32.8821 -32.8655 -32.8655 -13.9108 -13.9108 -13.8567 -13.8567
-12.5294 -12.5294 -12.4583 -12.4583 -12.4292 -12.4292 -12.3725 -12.3725
1.4732 1.4732 2.1346 2.1346 2.2010 2.2010 2.2373 2.2373
2.3336 2.3336 2.5194 2.5194 2.5352 2.5352 2.5594 2.5594
2.6299 2.6299 2.6856 2.6856 2.6950 2.6950 3.2810 3.2810
6.6923 6.6923 8.6430 8.6430 8.6514 8.6514 9.3220 9.3220
9.9613 9.9613 9.9640 9.9640 9.9981 9.9981 10.0242 10.0242
11.0787 11.0787 11.5510 11.5510 11.6248 11.6248
k = 0.0000 0.0000 0.1777 ( 4247 PWs) bands (ev):
-32.8815 -32.8815 -32.8661 -32.8661 -13.9085 -13.9085 -13.8585 -13.8585
-12.5240 -12.5240 -12.4573 -12.4573 -12.4303 -12.4303 -12.3790 -12.3790
1.5055 1.5055 2.1245 2.1245 2.2024 2.2024 2.2359 2.2359
2.3372 2.3372 2.5177 2.5177 2.5306 2.5306 2.5580 2.5580
2.6320 2.6320 2.6834 2.6834 2.6990 2.6990 3.2156 3.2156
6.8222 6.8222 8.6768 8.6768 8.6851 8.6851 9.2626 9.2626
9.8769 9.8769 9.8813 9.8813 10.0383 10.0383 10.0641 10.0641
11.1085 11.1085 11.4554 11.4554 11.5246 11.5246
k = 0.0000 0.0000 0.1914 ( 4253 PWs) bands (ev):
-32.8808 -32.8808 -32.8668 -32.8668 -13.9061 -13.9061 -13.8604 -13.8604
-12.5183 -12.5183 -12.4561 -12.4561 -12.4315 -12.4315 -12.3857 -12.3857
1.5396 1.5396 2.1125 2.1125 2.2039 2.2039 2.2345 2.2345
2.3413 2.3413 2.5123 2.5123 2.5288 2.5288 2.5566 2.5566
2.6341 2.6341 2.6811 2.6811 2.7036 2.7036 3.1532 3.1532
6.9550 6.9550 8.7132 8.7132 8.7215 8.7215 9.1930 9.1930
9.7946 9.7946 9.7996 9.7996 10.0816 10.0816 10.1084 10.1084
11.1405 11.1405 11.3610 11.3610 11.4262 11.4262
k = 0.0000 0.0000 0.2050 ( 4265 PWs) bands (ev):
-32.8801 -32.8801 -32.8675 -32.8675 -13.9035 -13.9035 -13.8624 -13.8624
-12.5122 -12.5122 -12.4549 -12.4549 -12.4327 -12.4327 -12.3928 -12.3928
1.5754 1.5754 2.0984 2.0984 2.2054 2.2054 2.2330 2.2330
2.3458 2.3458 2.5040 2.5040 2.5290 2.5290 2.5551 2.5551
2.6363 2.6363 2.6786 2.6786 2.7088 2.7088 3.0946 3.0946
7.0901 7.0901 8.7522 8.7522 8.7604 8.7604 9.1133 9.1133
9.7144 9.7144 9.7199 9.7199 10.1281 10.1281 10.1560 10.1560
11.1748 11.1748 11.2681 11.2681 11.3297 11.3297
k = 0.0000 0.0000 0.2187 ( 4265 PWs) bands (ev):
-32.8794 -32.8794 -32.8682 -32.8682 -13.9009 -13.9009 -13.8645 -13.8645
-12.5059 -12.5059 -12.4536 -12.4536 -12.4340 -12.4340 -12.4001 -12.4001
1.6128 1.6128 2.0820 2.0820 2.2070 2.2070 2.2314 2.2314
2.3509 2.3509 2.4940 2.4940 2.5300 2.5300 2.5535 2.5535
2.6387 2.6387 2.6762 2.6762 2.7149 2.7149 3.0404 3.0404
7.2270 7.2270 8.7938 8.7938 8.8019 8.8019 9.0239 9.0239
9.6366 9.6366 9.6424 9.6424 10.1776 10.1776 10.2069 10.2069
11.1772 11.1772 11.2112 11.2112 11.2356 11.2356
k = 0.0000 0.0000 0.2324 ( 4277 PWs) bands (ev):
-32.8787 -32.8787 -32.8690 -32.8690 -13.8982 -13.8982 -13.8667 -13.8667
-12.4992 -12.4992 -12.4523 -12.4523 -12.4353 -12.4353 -12.4076 -12.4076
1.6513 1.6513 2.0629 2.0629 2.2086 2.2086 2.2298 2.2298
2.3567 2.3567 2.4827 2.4827 2.5314 2.5314 2.5519 2.5519
2.6411 2.6411 2.6735 2.6735 2.7219 2.7219 2.9909 2.9909
7.3653 7.3653 8.8379 8.8379 8.8460 8.8460 8.9254 8.9254
9.5609 9.5609 9.5670 9.5670 10.2302 10.2302 10.2609 10.2609
11.0885 11.0885 11.1439 11.1439 11.2497 11.2497
k = 0.0000 0.0000 0.2461 ( 4283 PWs) bands (ev):
-32.8779 -32.8779 -32.8697 -32.8697 -13.8955 -13.8955 -13.8690 -13.8690
-12.4923 -12.4923 -12.4510 -12.4510 -12.4367 -12.4367 -12.4153 -12.4153
1.6908 1.6908 2.0410 2.0410 2.2103 2.2103 2.2281 2.2281
2.3631 2.3631 2.4706 2.4706 2.5329 2.5329 2.5502 2.5502
2.6436 2.6436 2.6709 2.6709 2.7301 2.7301 2.9465 2.9465
7.5045 7.5045 8.8186 8.8186 8.8846 8.8846 8.8926 8.8926
9.4875 9.4875 9.4939 9.4939 10.2859 10.2859 10.3181 10.3181
11.0021 11.0021 11.0548 11.0548 11.2901 11.2901
k = 0.0000 0.0000 0.2597 ( 4282 PWs) bands (ev):
-32.8771 -32.8771 -32.8705 -32.8705 -13.8927 -13.8927 -13.8714 -13.8714
-12.4851 -12.4851 -12.4496 -12.4496 -12.4381 -12.4381 -12.4231 -12.4231
1.7309 1.7309 2.0161 2.0161 2.2121 2.2121 2.2264 2.2264
2.3703 2.3703 2.4580 2.4580 2.5345 2.5345 2.5485 2.5485
2.6462 2.6462 2.6682 2.6682 2.7395 2.7395 2.9073 2.9073
7.6441 7.6441 8.7047 8.7047 8.9339 8.9339 8.9417 8.9417
9.4165 9.4165 9.4231 9.4231 10.3446 10.3446 10.3784 10.3784
10.9182 10.9182 10.9683 10.9683 11.3323 11.3323
k = 0.0000 0.0000 0.2734 ( 4282 PWs) bands (ev):
-32.8763 -32.8763 -32.8713 -32.8713 -13.8900 -13.8900 -13.8739 -13.8739
-12.4777 -12.4777 -12.4482 -12.4482 -12.4395 -12.4395 -12.4309 -12.4309
1.7711 1.7711 1.9882 1.9882 2.2138 2.2138 2.2246 2.2246
2.3784 2.3784 2.4450 2.4450 2.5362 2.5362 2.5468 2.5468
2.6489 2.6489 2.6655 2.6655 2.7506 2.7506 2.8731 2.8731
7.7837 7.7837 8.5844 8.5844 8.9856 8.9856 8.9934 8.9934
9.3477 9.3477 9.3545 9.3545 10.4063 10.4063 10.4418 10.4418
10.8368 10.8368 10.8845 10.8845 11.3760 11.3760
k = 0.0000 0.0000 0.2871 ( 4294 PWs) bands (ev):
-32.8755 -32.8755 -32.8722 -32.8722 -13.8872 -13.8872 -13.8765 -13.8765
-12.4702 -12.4702 -12.4468 -12.4468 -12.4409 -12.4409 -12.4389 -12.4389
1.8109 1.8109 1.9572 1.9572 2.2156 2.2156 2.2228 2.2228
2.3874 2.3874 2.4322 2.4322 2.5379 2.5379 2.5450 2.5450
2.6516 2.6516 2.6627 2.6627 2.7636 2.7636 2.8435 2.8435
7.9226 7.9226 8.4590 8.4590 9.0399 9.0399 9.0475 9.0475
9.2814 9.2814 9.2884 9.2884 10.4709 10.4709 10.5082 10.5082
10.7581 10.7581 10.8035 10.8035 11.4209 11.4209
k = 0.0000 0.0000 0.3007 ( 4276 PWs) bands (ev):
-32.8746 -32.8746 -32.8730 -32.8730 -13.8845 -13.8845 -13.8791 -13.8791
-12.4625 -12.4625 -12.4468 -12.4468 -12.4453 -12.4453 -12.4424 -12.4424
1.8500 1.8500 1.9236 1.9236 2.2175 2.2175 2.2211 2.2211
2.3974 2.3974 2.4199 2.4199 2.5397 2.5397 2.5433 2.5433
2.6544 2.6544 2.6599 2.6599 2.7789 2.7789 2.8184 2.8184
8.0602 8.0602 8.3292 8.3292 9.0966 9.0966 9.1041 9.1041
9.2174 9.2174 9.2245 9.2245 10.5385 10.5385 10.5776 10.5776
10.6821 10.6821 10.7253 10.7253 11.4664 11.4664
k = 0.0000 0.0000 0.3144 ( 4276 PWs) bands (ev):
-32.8738 -32.8738 -32.8738 -32.8738 -13.8817 -13.8817 -13.8817 -13.8817
-12.4547 -12.4547 -12.4547 -12.4547 -12.4438 -12.4438 -12.4438 -12.4438
1.8877 1.8877 1.8877 1.8877 2.2193 2.2193 2.2193 2.2193
2.4082 2.4082 2.4082 2.4082 2.5415 2.5415 2.5415 2.5415
2.6571 2.6571 2.6571 2.6571 2.7970 2.7970 2.7970 2.7970
8.1960 8.1960 8.1960 8.1960 9.1558 9.1558 9.1558 9.1558
9.1631 9.1631 9.1631 9.1631 10.6089 10.6089 10.6089 10.6089
10.6500 10.6500 10.6500 10.6500 11.5120 11.5120
k = 0.0000 0.0000 0.3144 ( 4276 PWs) bands (ev):
-32.8738 -32.8738 -32.8738 -32.8738 -13.8817 -13.8817 -13.8817 -13.8817
-12.4547 -12.4547 -12.4547 -12.4547 -12.4438 -12.4438 -12.4438 -12.4438
1.8877 1.8877 1.8877 1.8877 2.2193 2.2193 2.2193 2.2193
2.4082 2.4082 2.4082 2.4082 2.5415 2.5415 2.5415 2.5415
2.6571 2.6571 2.6571 2.6571 2.7970 2.7970 2.7970 2.7970
8.1960 8.1960 8.1960 8.1960 9.1558 9.1558 9.1558 9.1558
9.1631 9.1631 9.1631 9.1631 10.6089 10.6089 10.6089 10.6089
10.6500 10.6500 10.6500 10.6500 11.5120 11.5120
k = 0.0122 0.0070 0.3144 ( 4286 PWs) bands (ev):
-32.8738 -32.8738 -32.8738 -32.8738 -13.8818 -13.8818 -13.8818 -13.8818
-12.4547 -12.4547 -12.4547 -12.4547 -12.4439 -12.4439 -12.4439 -12.4439
1.8887 1.8887 1.8887 1.8887 2.2193 2.2193 2.2193 2.2193
2.4083 2.4083 2.4083 2.4083 2.5416 2.5416 2.5416 2.5416
2.6571 2.6571 2.6571 2.6571 2.7974 2.7974 2.7974 2.7974
8.1970 8.1970 8.1970 8.1970 9.1460 9.1460 9.1460 9.1460
9.1591 9.1591 9.1591 9.1591 10.6088 10.6088 10.6088 10.6088
10.6501 10.6501 10.6501 10.6501 11.5234 11.5234
k = 0.0244 0.0141 0.3144 ( 4298 PWs) bands (ev):
-32.8738 -32.8738 -32.8738 -32.8738 -13.8818 -13.8818 -13.8818 -13.8818
-12.4547 -12.4547 -12.4547 -12.4547 -12.4441 -12.4441 -12.4441 -12.4441
1.8916 1.8916 1.8916 1.8916 2.2195 2.2195 2.2195 2.2195
2.4087 2.4087 2.4087 2.4087 2.5418 2.5418 2.5418 2.5418
2.6569 2.6569 2.6569 2.6569 2.7987 2.7987 2.7987 2.7987
8.1999 8.1999 8.1999 8.1999 9.1111 9.1111 9.1111 9.1111
9.1535 9.1535 9.1535 9.1535 10.6078 10.6078 10.6078 10.6078
10.6507 10.6507 10.6507 10.6507 11.5572 11.5572
k = 0.0366 0.0211 0.3144 ( 4286 PWs) bands (ev):
-32.8738 -32.8738 -32.8738 -32.8738 -13.8820 -13.8820 -13.8820 -13.8820
-12.4548 -12.4548 -12.4548 -12.4548 -12.4443 -12.4443 -12.4443 -12.4443
1.8963 1.8963 1.8963 1.8963 2.2199 2.2199 2.2199 2.2199
2.4093 2.4093 2.4093 2.4093 2.5424 2.5424 2.5424 2.5424
2.6567 2.6567 2.6567 2.6567 2.8008 2.8008 2.8008 2.8008
8.2048 8.2048 8.2048 8.2048 9.0545 9.0545 9.0545 9.0545
9.1455 9.1455 9.1455 9.1455 10.6032 10.6032 10.6032 10.6032
10.6536 10.6536 10.6536 10.6536 11.6120 11.6120
k = 0.0488 0.0282 0.3144 ( 4286 PWs) bands (ev):
-32.8738 -32.8738 -32.8738 -32.8738 -13.8821 -13.8821 -13.8821 -13.8821
-12.4548 -12.4548 -12.4548 -12.4548 -12.4447 -12.4447 -12.4447 -12.4447
1.9029 1.9029 1.9029 1.9029 2.2205 2.2205 2.2205 2.2205
2.4101 2.4101 2.4101 2.4101 2.5430 2.5430 2.5430 2.5430
2.6563 2.6563 2.6563 2.6563 2.8038 2.8038 2.8038 2.8038
8.2115 8.2115 8.2115 8.2115 8.9800 8.9800 8.9800 8.9800
9.1346 9.1346 9.1346 9.1346 10.5923 10.5923 10.5923 10.5923
10.6605 10.6605 10.6605 10.6605 11.6859 11.6859
k = 0.0610 0.0352 0.3144 ( 4282 PWs) bands (ev):
-32.8737 -32.8737 -32.8737 -32.8737 -13.8823 -13.8823 -13.8823 -13.8823
-12.4549 -12.4549 -12.4549 -12.4549 -12.4452 -12.4452 -12.4452 -12.4452
1.9113 1.9113 1.9113 1.9113 2.2212 2.2212 2.2212 2.2212
2.4112 2.4112 2.4112 2.4112 2.5439 2.5439 2.5439 2.5439
2.6559 2.6559 2.6559 2.6559 2.8077 2.8077 2.8077 2.8077
8.2199 8.2199 8.2199 8.2199 8.8913 8.8913 8.8913 8.8913
9.1208 9.1208 9.1208 9.1208 10.5743 10.5743 10.5743 10.5743
10.6717 10.6717 10.6717 10.6717 11.7760 11.7760
k = 0.0732 0.0422 0.3144 ( 4282 PWs) bands (ev):
-32.8737 -32.8737 -32.8737 -32.8737 -13.8826 -13.8826 -13.8826 -13.8826
-12.4551 -12.4551 -12.4551 -12.4551 -12.4457 -12.4457 -12.4457 -12.4457
1.9213 1.9213 1.9213 1.9213 2.2221 2.2221 2.2221 2.2221
2.4127 2.4127 2.4127 2.4127 2.5450 2.5450 2.5450 2.5450
2.6554 2.6554 2.6554 2.6554 2.8125 2.8125 2.8125 2.8125
8.2297 8.2297 8.2297 8.2297 8.7917 8.7917 8.7917 8.7917
9.1044 9.1044 9.1044 9.1044 10.5498 10.5498 10.5498 10.5498
10.6869 10.6869 10.6869 10.6869 11.8792 11.8792
k = 0.0854 0.0493 0.3144 ( 4266 PWs) bands (ev):
-32.8736 -32.8736 -32.8736 -32.8736 -13.8829 -13.8829 -13.8829 -13.8829
-12.4553 -12.4553 -12.4553 -12.4553 -12.4463 -12.4463 -12.4463 -12.4463
1.9329 1.9329 1.9329 1.9329 2.2232 2.2232 2.2232 2.2232
2.4144 2.4144 2.4144 2.4144 2.5464 2.5464 2.5464 2.5464
2.6550 2.6550 2.6550 2.6550 2.8182 2.8182 2.8182 2.8182
8.2403 8.2403 8.2403 8.2403 8.6847 8.6847 8.6847 8.6847
9.0854 9.0854 9.0854 9.0854 10.5196 10.5196 10.5196 10.5196
10.7056 10.7056 10.7056 10.7056 11.9924 11.9924
k = 0.0976 0.0563 0.3144 ( 4254 PWs) bands (ev):
-32.8736 -32.8736 -32.8736 -32.8736 -13.8833 -13.8833 -13.8833 -13.8833
-12.4555 -12.4555 -12.4555 -12.4555 -12.4470 -12.4470 -12.4470 -12.4470
1.9459 1.9459 1.9459 1.9459 2.2244 2.2244 2.2244 2.2244
2.4164 2.4164 2.4164 2.4164 2.5479 2.5479 2.5479 2.5479
2.6544 2.6544 2.6544 2.6544 2.8250 2.8250 2.8250 2.8250
8.2499 8.2499 8.2499 8.2499 8.5740 8.5740 8.5740 8.5740
9.0641 9.0641 9.0641 9.0641 10.4846 10.4846 10.4846 10.4846
10.7275 10.7275 10.7275 10.7275 12.1122 12.1122
k = 0.1098 0.0634 0.3144 ( 4262 PWs) bands (ev):
-32.8735 -32.8735 -32.8735 -32.8735 -13.8837 -13.8837 -13.8837 -13.8837
-12.4558 -12.4558 -12.4558 -12.4558 -12.4477 -12.4477 -12.4477 -12.4477
1.9600 1.9600 1.9600 1.9600 2.2259 2.2259 2.2259 2.2259
2.4188 2.4188 2.4188 2.4188 2.5497 2.5497 2.5497 2.5497
2.6539 2.6539 2.6539 2.6539 2.8329 2.8329 2.8329 2.8329
8.2526 8.2526 8.2526 8.2526 8.4674 8.4674 8.4674 8.4674
9.0407 9.0407 9.0407 9.0407 10.4457 10.4457 10.4457 10.4457
10.7525 10.7525 10.7525 10.7525 12.2350 12.2350
k = 0.1220 0.0704 0.3144 ( 4266 PWs) bands (ev):
-32.8735 -32.8735 -32.8735 -32.8735 -13.8841 -13.8841 -13.8841 -13.8841
-12.4562 -12.4562 -12.4562 -12.4562 -12.4484 -12.4484 -12.4484 -12.4484
1.9752 1.9752 1.9752 1.9752 2.2276 2.2276 2.2276 2.2276
2.4216 2.4216 2.4216 2.4216 2.5517 2.5517 2.5517 2.5517
2.6533 2.6533 2.6533 2.6533 2.8418 2.8418 2.8418 2.8418
8.2256 8.2256 8.2256 8.2256 8.3891 8.3891 8.3891 8.3891
9.0154 9.0154 9.0154 9.0154 10.4036 10.4036 10.4036 10.4036
10.7805 10.7805 10.7805 10.7805 12.3570 12.3570
k = 0.1341 0.0774 0.3144 ( 4254 PWs) bands (ev):
-32.8734 -32.8734 -32.8734 -32.8734 -13.8845 -13.8845 -13.8845 -13.8845
-12.4568 -12.4568 -12.4568 -12.4568 -12.4491 -12.4491 -12.4491 -12.4491
1.9912 1.9912 1.9912 1.9912 2.2296 2.2296 2.2296 2.2296
2.4247 2.4247 2.4247 2.4247 2.5540 2.5540 2.5540 2.5540
2.6528 2.6528 2.6528 2.6528 2.8522 2.8522 2.8522 2.8522
8.1409 8.1409 8.1409 8.1409 8.3679 8.3679 8.3679 8.3679
8.9885 8.9885 8.9885 8.9885 10.3589 10.3589 10.3589 10.3589
10.8113 10.8113 10.8113 10.8113 12.4733 12.4733
k = 0.1463 0.0845 0.3144 ( 4258 PWs) bands (ev):
-32.8734 -32.8734 -32.8734 -32.8734 -13.8850 -13.8850 -13.8850 -13.8850
-12.4574 -12.4574 -12.4574 -12.4574 -12.4497 -12.4497 -12.4497 -12.4497
2.0077 2.0077 2.0077 2.0077 2.2318 2.2318 2.2318 2.2318
2.4283 2.4283 2.4283 2.4283 2.5565 2.5565 2.5565 2.5565
2.6523 2.6523 2.6523 2.6523 2.8639 2.8639 2.8639 2.8639
8.0254 8.0254 8.0254 8.0254 8.3779 8.3779 8.3779 8.3779
8.9602 8.9602 8.9602 8.9602 10.3123 10.3123 10.3123 10.3123
10.8450 10.8450 10.8450 10.8450 12.5775 12.5775
k = 0.1585 0.0915 0.3144 ( 4262 PWs) bands (ev):
-32.8733 -32.8733 -32.8733 -32.8733 -13.8856 -13.8856 -13.8856 -13.8856
-12.4582 -12.4582 -12.4582 -12.4582 -12.4503 -12.4503 -12.4503 -12.4503
2.0245 2.0245 2.0245 2.0245 2.2344 2.2344 2.2344 2.2344
2.4323 2.4323 2.4323 2.4323 2.5593 2.5593 2.5593 2.5593
2.6518 2.6518 2.6518 2.6518 2.8771 2.8771 2.8771 2.8771
7.9005 7.9005 7.9005 7.9005 8.3984 8.3984 8.3984 8.3984
8.9307 8.9307 8.9307 8.9307 10.2642 10.2642 10.2642 10.2642
10.8814 10.8814 10.8814 10.8814 12.6632 12.6632
k = 0.1707 0.0986 0.3144 ( 4260 PWs) bands (ev):
-32.8732 -32.8732 -32.8732 -32.8732 -13.8861 -13.8861 -13.8861 -13.8861
-12.4592 -12.4592 -12.4592 -12.4592 -12.4508 -12.4508 -12.4508 -12.4508
2.0411 2.0411 2.0411 2.0411 2.2373 2.2373 2.2373 2.2373
2.4368 2.4368 2.4368 2.4368 2.5625 2.5625 2.5625 2.5625
2.6514 2.6514 2.6514 2.6514 2.8922 2.8922 2.8922 2.8922
7.7720 7.7720 7.7720 7.7720 8.4239 8.4239 8.4239 8.4239
8.9003 8.9003 8.9003 8.9003 10.2152 10.2152 10.2152 10.2152
10.9206 10.9206 10.9206 10.9206 12.7256 12.7256
k = 0.1829 0.1056 0.3144 ( 4264 PWs) bands (ev):
-32.8731 -32.8731 -32.8731 -32.8731 -13.8867 -13.8867 -13.8867 -13.8867
-12.4603 -12.4603 -12.4603 -12.4603 -12.4512 -12.4512 -12.4512 -12.4512
2.0573 2.0573 2.0573 2.0573 2.2406 2.2406 2.2406 2.2406
2.4418 2.4418 2.4418 2.4418 2.5660 2.5660 2.5660 2.5660
2.6511 2.6511 2.6511 2.6511 2.9092 2.9092 2.9092 2.9092
7.6420 7.6420 7.6420 7.6420 8.4526 8.4526 8.4526 8.4526
8.8692 8.8692 8.8692 8.8692 10.1655 10.1655 10.1655 10.1655
10.9624 10.9624 10.9624 10.9624 12.7648 12.7648
k = 0.1951 0.1127 0.3144 ( 4264 PWs) bands (ev):
-32.8731 -32.8731 -32.8731 -32.8731 -13.8873 -13.8873 -13.8873 -13.8873
-12.4615 -12.4615 -12.4615 -12.4615 -12.4515 -12.4515 -12.4515 -12.4515
2.0728 2.0728 2.0728 2.0728 2.2442 2.2442 2.2442 2.2442
2.4471 2.4471 2.4471 2.4471 2.5699 2.5699 2.5699 2.5699
2.6508 2.6508 2.6508 2.6508 2.9284 2.9284 2.9284 2.9284
7.5115 7.5115 7.5115 7.5115 8.4841 8.4841 8.4841 8.4841
8.8377 8.8377 8.8377 8.8377 10.1155 10.1155 10.1155 10.1155
11.0068 11.0068 11.0068 11.0068 12.7843 12.7843
k = 0.2073 0.1197 0.3144 ( 4262 PWs) bands (ev):
-32.8730 -32.8730 -32.8730 -32.8730 -13.8880 -13.8880 -13.8880 -13.8880
-12.4628 -12.4628 -12.4628 -12.4628 -12.4517 -12.4517 -12.4517 -12.4517
2.0873 2.0873 2.0873 2.0873 2.2483 2.2483 2.2483 2.2483
2.4529 2.4529 2.4529 2.4529 2.5742 2.5742 2.5742 2.5742
2.6506 2.6506 2.6506 2.6506 2.9501 2.9501 2.9501 2.9501
7.3810 7.3810 7.3810 7.3810 8.5179 8.5179 8.5179 8.5179
8.8059 8.8059 8.8059 8.8059 10.0656 10.0656 10.0656 10.0656
11.0537 11.0537 11.0537 11.0537 12.7889 12.7889
k = 0.2195 0.1267 0.3144 ( 4266 PWs) bands (ev):
-32.8729 -32.8729 -32.8729 -32.8729 -13.8886 -13.8886 -13.8886 -13.8886
-12.4643 -12.4643 -12.4643 -12.4643 -12.4520 -12.4520 -12.4520 -12.4520
2.1006 2.1006 2.1006 2.1006 2.2526 2.2526 2.2526 2.2526
2.4589 2.4589 2.4589 2.4589 2.5788 2.5788 2.5788 2.5788
2.6504 2.6504 2.6504 2.6504 2.9744 2.9744 2.9744 2.9744
7.2509 7.2509 7.2509 7.2509 8.5537 8.5537 8.5537 8.5537
8.7742 8.7742 8.7742 8.7742 10.0160 10.0160 10.0160 10.0160
11.1032 11.1032 11.1032 11.1032 12.7827 12.7827
k = 0.2317 0.1338 0.3144 ( 4278 PWs) bands (ev):
-32.8728 -32.8728 -32.8728 -32.8728 -13.8892 -13.8892 -13.8892 -13.8892
-12.4657 -12.4657 -12.4657 -12.4657 -12.4522 -12.4522 -12.4522 -12.4522
2.1125 2.1125 2.1125 2.1125 2.2573 2.2573 2.2573 2.2573
2.4651 2.4651 2.4651 2.4651 2.5838 2.5838 2.5838 2.5838
2.6504 2.6504 2.6504 2.6504 3.0017 3.0017 3.0017 3.0017
7.1213 7.1213 7.1213 7.1213 8.5913 8.5913 8.5913 8.5913
8.7428 8.7428 8.7428 8.7428 9.9669 9.9669 9.9669 9.9669
11.1550 11.1550 11.1550 11.1550 12.7689 12.7689
k = 0.2439 0.1408 0.3144 ( 4288 PWs) bands (ev):
-32.8727 -32.8727 -32.8727 -32.8727 -13.8899 -13.8899 -13.8899 -13.8899
-12.4672 -12.4672 -12.4672 -12.4672 -12.4523 -12.4523 -12.4523 -12.4523
2.1230 2.1230 2.1230 2.1230 2.2621 2.2621 2.2621 2.2621
2.4714 2.4714 2.4714 2.4714 2.5892 2.5892 2.5892 2.5892
2.6504 2.6504 2.6504 2.6504 3.0321 3.0321 3.0321 3.0321
6.9927 6.9927 6.9927 6.9927 8.6297 8.6297 8.6297 8.6297
8.7128 8.7128 8.7128 8.7128 9.9186 9.9186 9.9186 9.9186
11.2092 11.2092 11.2092 11.2092 12.7497 12.7497
k = 0.2561 0.1479 0.3144 ( 4288 PWs) bands (ev):
-32.8726 -32.8726 -32.8726 -32.8726 -13.8906 -13.8906 -13.8906 -13.8906
-12.4688 -12.4688 -12.4688 -12.4688 -12.4524 -12.4524 -12.4524 -12.4524
2.1321 2.1321 2.1321 2.1321 2.2671 2.2671 2.2671 2.2671
2.4777 2.4777 2.4777 2.4777 2.5949 2.5949 2.5949 2.5949
2.6505 2.6505 2.6505 2.6505 3.0659 3.0659 3.0659 3.0659
6.8651 6.8651 6.8651 6.8651 8.6599 8.6599 8.6599 8.6599
8.6934 8.6934 8.6934 8.6934 9.8714 9.8714 9.8714 9.8714
11.2657 11.2657 11.2657 11.2657 12.7267 12.7267
k = 0.2683 0.1549 0.3144 ( 4280 PWs) bands (ev):
-32.8725 -32.8725 -32.8725 -32.8725 -13.8912 -13.8912 -13.8912 -13.8912
-12.4703 -12.4703 -12.4703 -12.4703 -12.4525 -12.4525 -12.4525 -12.4525
2.1399 2.1399 2.1399 2.1399 2.2720 2.2720 2.2720 2.2720
2.4837 2.4837 2.4837 2.4837 2.6008 2.6008 2.6008 2.6008
2.6508 2.6508 2.6508 2.6508 3.1031 3.1031 3.1031 3.1031
6.7386 6.7386 6.7386 6.7386 8.6438 8.6438 8.6438 8.6438
8.7223 8.7223 8.7223 8.7223 9.8254 9.8254 9.8254 9.8254
11.3243 11.3243 11.3243 11.3243 12.7008 12.7008
k = 0.2805 0.1619 0.3144 ( 4284 PWs) bands (ev):
-32.8725 -32.8725 -32.8725 -32.8725 -13.8919 -13.8919 -13.8919 -13.8919
-12.4718 -12.4718 -12.4718 -12.4718 -12.4526 -12.4526 -12.4526 -12.4526
2.1465 2.1465 2.1465 2.1465 2.2767 2.2767 2.2767 2.2767
2.4895 2.4895 2.4895 2.4895 2.6067 2.6067 2.6067 2.6067
2.6512 2.6512 2.6512 2.6512 3.1438 3.1438 3.1438 3.1438
6.6135 6.6135 6.6135 6.6135 8.6158 8.6158 8.6158 8.6158
8.7654 8.7654 8.7654 8.7654 9.7809 9.7809 9.7809 9.7809
11.3850 11.3850 11.3850 11.3850 12.6727 12.6727
k = 0.2927 0.1690 0.3144 ( 4278 PWs) bands (ev):
-32.8724 -32.8724 -32.8724 -32.8724 -13.8925 -13.8925 -13.8925 -13.8925
-12.4734 -12.4734 -12.4734 -12.4734 -12.4527 -12.4527 -12.4527 -12.4527
2.1520 2.1520 2.1520 2.1520 2.2812 2.2812 2.2812 2.2812
2.4949 2.4949 2.4949 2.4949 2.6127 2.6127 2.6127 2.6127
2.6518 2.6518 2.6518 2.6518 3.1881 3.1881 3.1881 3.1881
6.4898 6.4898 6.4898 6.4898 8.5875 8.5875 8.5875 8.5875
8.8110 8.8110 8.8110 8.8110 9.7380 9.7380 9.7380 9.7380
11.4477 11.4477 11.4477 11.4477 12.6426 12.6426
k = 0.3049 0.1760 0.3144 ( 4274 PWs) bands (ev):
-32.8723 -32.8723 -32.8723 -32.8723 -13.8931 -13.8931 -13.8931 -13.8931
-12.4749 -12.4749 -12.4749 -12.4749 -12.4528 -12.4528 -12.4528 -12.4528
2.1567 2.1567 2.1567 2.1567 2.2855 2.2855 2.2855 2.2855
2.4999 2.4999 2.4999 2.4999 2.6184 2.6184 2.6184 2.6184
2.6525 2.6525 2.6525 2.6525 3.2359 3.2359 3.2359 3.2359
6.3676 6.3676 6.3676 6.3676 8.5599 8.5599 8.5599 8.5599
8.8579 8.8579 8.8579 8.8579 9.6970 9.6970 9.6970 9.6970
11.5123 11.5123 11.5123 11.5123 12.6105 12.6105
k = 0.3171 0.1831 0.3144 ( 4272 PWs) bands (ev):
-32.8722 -32.8722 -32.8722 -32.8722 -13.8937 -13.8937 -13.8937 -13.8937
-12.4763 -12.4763 -12.4763 -12.4763 -12.4528 -12.4528 -12.4528 -12.4528
2.1606 2.1606 2.1606 2.1606 2.2893 2.2893 2.2893 2.2893
2.5045 2.5045 2.5045 2.5045 2.6238 2.6238 2.6238 2.6238
2.6535 2.6535 2.6535 2.6535 3.2870 3.2870 3.2870 3.2870
6.2471 6.2471 6.2471 6.2471 8.5334 8.5334 8.5334 8.5334
8.9056 8.9056 8.9056 8.9056 9.6581 9.6581 9.6581 9.6581
11.5785 11.5785 11.5785 11.5785 12.5761 12.5761
k = 0.3293 0.1901 0.3144 ( 4266 PWs) bands (ev):
-32.8721 -32.8721 -32.8721 -32.8721 -13.8943 -13.8943 -13.8943 -13.8943
-12.4777 -12.4777 -12.4777 -12.4777 -12.4529 -12.4529 -12.4529 -12.4529
2.1639 2.1639 2.1639 2.1639 2.2929 2.2929 2.2929 2.2929
2.5087 2.5087 2.5087 2.5087 2.6288 2.6288 2.6288 2.6288
2.6548 2.6548 2.6548 2.6548 3.3413 3.3413 3.3413 3.3413
6.1284 6.1284 6.1284 6.1284 8.5080 8.5080 8.5080 8.5080
8.9538 8.9538 8.9538 8.9538 9.6216 9.6216 9.6216 9.6216
11.6462 11.6462 11.6462 11.6462 12.5390 12.5390
k = 0.3415 0.1971 0.3144 ( 4266 PWs) bands (ev):
-32.8721 -32.8721 -32.8721 -32.8721 -13.8949 -13.8949 -13.8949 -13.8949
-12.4791 -12.4791 -12.4791 -12.4791 -12.4530 -12.4530 -12.4530 -12.4530
2.1667 2.1667 2.1667 2.1667 2.2961 2.2961 2.2961 2.2961
2.5124 2.5124 2.5124 2.5124 2.6330 2.6330 2.6330 2.6330
2.6565 2.6565 2.6565 2.6565 3.3987 3.3987 3.3987 3.3987
6.0117 6.0117 6.0117 6.0117 8.4839 8.4839 8.4839 8.4839
9.0019 9.0019 9.0019 9.0019 9.5877 9.5877 9.5877 9.5877
11.7153 11.7153 11.7153 11.7153 12.4988 12.4988
k = 0.3537 0.2042 0.3144 ( 4270 PWs) bands (ev):
-32.8720 -32.8720 -32.8720 -32.8720 -13.8954 -13.8954 -13.8954 -13.8954
-12.4804 -12.4804 -12.4804 -12.4804 -12.4530 -12.4530 -12.4530 -12.4530
2.1690 2.1690 2.1690 2.1690 2.2989 2.2989 2.2989 2.2989
2.5158 2.5158 2.5158 2.5158 2.6365 2.6365 2.6365 2.6365
2.6587 2.6587 2.6587 2.6587 3.4588 3.4588 3.4588 3.4588
5.8970 5.8970 5.8970 5.8970 8.4612 8.4612 8.4612 8.4612
9.0494 9.0494 9.0494 9.0494 9.5567 9.5567 9.5567 9.5567
11.7854 11.7854 11.7854 11.7854 12.4549 12.4549
k = 0.3659 0.2112 0.3144 ( 4272 PWs) bands (ev):
-32.8719 -32.8719 -32.8719 -32.8719 -13.8960 -13.8960 -13.8960 -13.8960
-12.4816 -12.4816 -12.4816 -12.4816 -12.4530 -12.4530 -12.4530 -12.4530
2.1709 2.1709 2.1709 2.1709 2.3014 2.3014 2.3014 2.3014
2.5189 2.5189 2.5189 2.5189 2.6393 2.6393 2.6393 2.6393
2.6612 2.6612 2.6612 2.6612 3.5213 3.5213 3.5213 3.5213
5.7847 5.7847 5.7847 5.7847 8.4400 8.4400 8.4400 8.4400
9.0955 9.0955 9.0955 9.0955 9.5292 9.5292 9.5292 9.5292
11.8563 11.8563 11.8563 11.8563 12.4071 12.4071
k = 0.3780 0.2183 0.3144 ( 4276 PWs) bands (ev):
-32.8719 -32.8719 -32.8719 -32.8719 -13.8964 -13.8964 -13.8964 -13.8964
-12.4827 -12.4827 -12.4827 -12.4827 -12.4531 -12.4531 -12.4531 -12.4531
2.1726 2.1726 2.1726 2.1726 2.3037 2.3037 2.3037 2.3037
2.5216 2.5216 2.5216 2.5216 2.6414 2.6414 2.6414 2.6414
2.6640 2.6640 2.6640 2.6640 3.5860 3.5860 3.5860 3.5860
5.6749 5.6749 5.6749 5.6749 8.4204 8.4204 8.4204 8.4204
9.1392 9.1392 9.1392 9.1392 9.5056 9.5056 9.5056 9.5056
11.9276 11.9276 11.9276 11.9276 12.3557 12.3557
k = 0.3902 0.2253 0.3144 ( 4268 PWs) bands (ev):
-32.8718 -32.8718 -32.8718 -32.8718 -13.8969 -13.8969 -13.8969 -13.8969
-12.4838 -12.4838 -12.4838 -12.4838 -12.4531 -12.4531 -12.4531 -12.4531
2.1739 2.1739 2.1739 2.1739 2.3056 2.3056 2.3056 2.3056
2.5239 2.5239 2.5239 2.5239 2.6430 2.6430 2.6430 2.6430
2.6668 2.6668 2.6668 2.6668 3.6524 3.6524 3.6524 3.6524
5.5681 5.5681 5.5681 5.5681 8.4025 8.4025 8.4025 8.4025
9.1792 9.1792 9.1792 9.1792 9.4870 9.4870 9.4870 9.4870
11.9988 11.9988 11.9988 11.9988 12.3016 12.3016
k = 0.4024 0.2323 0.3144 ( 4278 PWs) bands (ev):
-32.8717 -32.8717 -32.8717 -32.8717 -13.8973 -13.8973 -13.8973 -13.8973
-12.4848 -12.4848 -12.4848 -12.4848 -12.4531 -12.4531 -12.4531 -12.4531
2.1751 2.1751 2.1751 2.1751 2.3073 2.3073 2.3073 2.3073
2.5260 2.5260 2.5260 2.5260 2.6441 2.6441 2.6441 2.6441
2.6696 2.6696 2.6696 2.6696 3.7199 3.7199 3.7199 3.7199
5.4645 5.4645 5.4645 5.4645 8.3863 8.3863 8.3863 8.3863
9.2138 9.2138 9.2138 9.2138 9.4745 9.4745 9.4745 9.4745
12.0693 12.0693 12.0693 12.0693 12.2462 12.2462
k = 0.4146 0.2394 0.3144 ( 4274 PWs) bands (ev):
-32.8717 -32.8717 -32.8717 -32.8717 -13.8977 -13.8977 -13.8977 -13.8977
-12.4856 -12.4856 -12.4856 -12.4856 -12.4531 -12.4531 -12.4531 -12.4531
2.1761 2.1761 2.1761 2.1761 2.3087 2.3087 2.3087 2.3087
2.5278 2.5278 2.5278 2.5278 2.6451 2.6451 2.6451 2.6451
2.6723 2.6723 2.6723 2.6723 3.7880 3.7880 3.7880 3.7880
5.3650 5.3650 5.3650 5.3650 8.3719 8.3719 8.3719 8.3719
9.2410 9.2410 9.2410 9.2410 9.4694 9.4694 9.4694 9.4694
12.1375 12.1375 12.1375 12.1375 12.1922 12.1922
k = 0.4268 0.2464 0.3144 ( 4278 PWs) bands (ev):
-32.8717 -32.8717 -32.8717 -32.8717 -13.8980 -13.8980 -13.8980 -13.8980
-12.4864 -12.4864 -12.4864 -12.4864 -12.4532 -12.4532 -12.4532 -12.4532
2.1769 2.1769 2.1769 2.1769 2.3100 2.3100 2.3100 2.3100
2.5294 2.5294 2.5294 2.5294 2.6458 2.6458 2.6458 2.6458
2.6746 2.6746 2.6746 2.6746 3.8555 3.8555 3.8555 3.8555
5.2702 5.2702 5.2702 5.2702 8.3593 8.3593 8.3593 8.3593
9.2595 9.2595 9.2595 9.2595 9.4722 9.4722 9.4722 9.4722
12.1367 12.1367 12.1367 12.1367 12.2071 12.2071
k = 0.4390 0.2535 0.3144 ( 4274 PWs) bands (ev):
-32.8716 -32.8716 -32.8716 -32.8716 -13.8982 -13.8982 -13.8982 -13.8982
-12.4870 -12.4870 -12.4870 -12.4870 -12.4532 -12.4532 -12.4532 -12.4532
2.1775 2.1775 2.1775 2.1775 2.3110 2.3110 2.3110 2.3110
2.5307 2.5307 2.5307 2.5307 2.6463 2.6463 2.6463 2.6463
2.6767 2.6767 2.6767 2.6767 3.9213 3.9213 3.9213 3.9213
5.1815 5.1815 5.1815 5.1815 8.3486 8.3486 8.3486 8.3486
9.2697 9.2697 9.2697 9.2697 9.4819 9.4819 9.4819 9.4819
12.0891 12.0891 12.0891 12.0891 12.2695 12.2695
k = 0.4512 0.2605 0.3144 ( 4276 PWs) bands (ev):
-32.8716 -32.8716 -32.8716 -32.8716 -13.8985 -13.8985 -13.8985 -13.8985
-12.4876 -12.4876 -12.4876 -12.4876 -12.4532 -12.4532 -12.4532 -12.4532
2.1780 2.1780 2.1780 2.1780 2.3118 2.3118 2.3118 2.3118
2.5317 2.5317 2.5317 2.5317 2.6467 2.6467 2.6467 2.6467
2.6784 2.6784 2.6784 2.6784 3.9833 3.9833 3.9833 3.9833
5.1008 5.1008 5.1008 5.1008 8.3398 8.3398 8.3398 8.3398
9.2739 9.2739 9.2739 9.2739 9.4955 9.4955 9.4955 9.4955
12.0470 12.0470 12.0470 12.0470 12.3267 12.3267
k = 0.4634 0.2676 0.3144 ( 4268 PWs) bands (ev):
-32.8716 -32.8716 -32.8716 -32.8716 -13.8986 -13.8986 -13.8986 -13.8986
-12.4880 -12.4880 -12.4880 -12.4880 -12.4532 -12.4532 -12.4532 -12.4532
2.1784 2.1784 2.1784 2.1784 2.3124 2.3124 2.3124 2.3124
2.5325 2.5325 2.5325 2.5325 2.6470 2.6470 2.6470 2.6470
2.6798 2.6798 2.6798 2.6798 4.0389 4.0389 4.0389 4.0389
5.0307 5.0307 5.0307 5.0307 8.3329 8.3329 8.3329 8.3329
9.2746 9.2746 9.2746 9.2746 9.5096 9.5096 9.5096 9.5096
12.0124 12.0124 12.0124 12.0124 12.3761 12.3761
k = 0.4756 0.2746 0.3144 ( 4264 PWs) bands (ev):
-32.8715 -32.8715 -32.8715 -32.8715 -13.8988 -13.8988 -13.8988 -13.8988
-12.4883 -12.4883 -12.4883 -12.4883 -12.4532 -12.4532 -12.4532 -12.4532
2.1787 2.1787 2.1787 2.1787 2.3128 2.3128 2.3128 2.3128
2.5331 2.5331 2.5331 2.5331 2.6473 2.6473 2.6473 2.6473
2.6808 2.6808 2.6808 2.6808 4.0841 4.0841 4.0841 4.0841
4.9752 4.9752 4.9752 4.9752 8.3279 8.3279 8.3279 8.3279
9.2739 9.2739 9.2739 9.2739 9.5214 9.5214 9.5214 9.5214
11.9868 11.9868 11.9868 11.9868 12.4148 12.4148
k = 0.4878 0.2816 0.3144 ( 4260 PWs) bands (ev):
-32.8715 -32.8715 -32.8715 -32.8715 -13.8988 -13.8988 -13.8988 -13.8988
-12.4885 -12.4885 -12.4885 -12.4885 -12.4532 -12.4532 -12.4532 -12.4532
2.1788 2.1788 2.1788 2.1788 2.3131 2.3131 2.3131 2.3131
2.5335 2.5335 2.5335 2.5335 2.6474 2.6474 2.6474 2.6474
2.6814 2.6814 2.6814 2.6814 4.1143 4.1143 4.1143 4.1143
4.9388 4.9388 4.9388 4.9388 8.3250 8.3250 8.3250 8.3250
9.2730 9.2730 9.2730 9.2730 9.5292 9.5292 9.5292 9.5292
11.9710 11.9710 11.9710 11.9710 12.4396 12.4396
k = 0.5000 0.2887 0.3144 ( 4256 PWs) bands (ev):
-32.8715 -32.8715 -32.8715 -32.8715 -13.8989 -13.8989 -13.8989 -13.8989
-12.4885 -12.4885 -12.4885 -12.4885 -12.4532 -12.4532 -12.4532 -12.4532
2.1789 2.1789 2.1789 2.1789 2.3132 2.3132 2.3132 2.3132
2.5336 2.5336 2.5336 2.5336 2.6475 2.6475 2.6475 2.6475
2.6816 2.6816 2.6816 2.6816 4.1250 4.1250 4.1250 4.1250
4.9261 4.9261 4.9261 4.9261 8.3240 8.3240 8.3240 8.3240
9.2727 9.2727 9.2727 9.2727 9.5319 9.5319 9.5319 9.5319
11.9657 11.9657 11.9657 11.9657 12.4482 12.4482
k = 0.5000 0.2887 0.3144 ( 4256 PWs) bands (ev):
-32.8715 -32.8715 -32.8715 -32.8715 -13.8989 -13.8989 -13.8989 -13.8989
-12.4885 -12.4885 -12.4885 -12.4885 -12.4532 -12.4532 -12.4532 -12.4532
2.1789 2.1789 2.1789 2.1789 2.3132 2.3132 2.3132 2.3132
2.5336 2.5336 2.5336 2.5336 2.6475 2.6475 2.6475 2.6475
2.6816 2.6816 2.6816 2.6816 4.1250 4.1250 4.1250 4.1250
4.9261 4.9261 4.9261 4.9261 8.3240 8.3240 8.3240 8.3240
9.2727 9.2727 9.2727 9.2727 9.5319 9.5319 9.5319 9.5319
11.9657 11.9657 11.9657 11.9657 12.4482 12.4482
k = 0.4931 0.3007 0.3144 ( 4258 PWs) bands (ev):
-32.8715 -32.8715 -32.8715 -32.8715 -13.8989 -13.8989 -13.8989 -13.8989
-12.4885 -12.4885 -12.4885 -12.4885 -12.4532 -12.4532 -12.4532 -12.4532
2.1756 2.1756 2.1826 2.1826 2.3131 2.3131 2.3133 2.3133
2.5289 2.5289 2.5382 2.5382 2.6474 2.6474 2.6474 2.6474
2.6814 2.6814 2.6817 2.6817 4.1252 4.1252 4.1267 4.1267
4.9267 4.9267 4.9267 4.9267 8.3134 8.3134 8.3162 8.3162
9.2767 9.2767 9.2774 9.2774 9.5319 9.5319 9.5324 9.5324
11.9725 11.9725 11.9727 11.9727 12.4476 12.4476
k = 0.4861 0.3127 0.3144 ( 4262 PWs) bands (ev):
-32.8715 -32.8715 -32.8715 -32.8715 -13.8989 -13.8989 -13.8989 -13.8989
-12.4885 -12.4885 -12.4884 -12.4884 -12.4533 -12.4533 -12.4533 -12.4533
2.1725 2.1725 2.1865 2.1865 2.3131 2.3131 2.3134 2.3134
2.5242 2.5242 2.5429 2.5429 2.6473 2.6473 2.6474 2.6474
2.6811 2.6811 2.6819 2.6819 4.1275 4.1275 4.1304 4.1304
4.9284 4.9284 4.9285 4.9285 8.2853 8.2853 8.2908 8.2908
9.2891 9.2891 9.2903 9.2903 9.5323 9.5323 9.5334 9.5334
11.9930 11.9930 11.9933 11.9933 12.4487 12.4487
k = 0.4792 0.3248 0.3144 ( 4270 PWs) bands (ev):
-32.8715 -32.8715 -32.8715 -32.8715 -13.8990 -13.8990 -13.8989 -13.8989
-12.4885 -12.4885 -12.4884 -12.4884 -12.4535 -12.4535 -12.4535 -12.4535
2.1698 2.1698 2.1908 2.1908 2.3130 2.3130 2.3135 2.3135
2.5195 2.5195 2.5474 2.5474 2.6472 2.6472 2.6473 2.6473
2.6807 2.6807 2.6819 2.6819 4.1318 4.1318 4.1362 4.1362
4.9313 4.9313 4.9314 4.9314 8.2419 8.2419 8.2496 8.2496
9.3080 9.3080 9.3094 9.3094 9.5333 9.5333 9.5350 9.5350
12.0267 12.0267 12.0271 12.0271 12.4512 12.4512
k = 0.4722 0.3368 0.3144 ( 4264 PWs) bands (ev):
-32.8715 -32.8715 -32.8715 -32.8715 -13.8990 -13.8990 -13.8989 -13.8989
-12.4885 -12.4885 -12.4883 -12.4883 -12.4537 -12.4537 -12.4537 -12.4537
2.1675 2.1675 2.1954 2.1954 2.3130 2.3130 2.3136 2.3136
2.5149 2.5149 2.5520 2.5520 2.6470 2.6470 2.6471 2.6471
2.6803 2.6803 2.6820 2.6820 4.1381 4.1381 4.1439 4.1439
4.9352 4.9352 4.9354 4.9354 8.1856 8.1856 8.1954 8.1954
9.3311 9.3311 9.3323 9.3323 9.5351 9.5351 9.5375 9.5375
12.0727 12.0727 12.0731 12.0731 12.4540 12.4540
k = 0.4653 0.3488 0.3144 ( 4268 PWs) bands (ev):
-32.8715 -32.8715 -32.8715 -32.8715 -13.8991 -13.8991 -13.8990 -13.8990
-12.4884 -12.4884 -12.4882 -12.4882 -12.4539 -12.4539 -12.4539 -12.4539
2.1655 2.1655 2.2002 2.2002 2.3130 2.3130 2.3138 2.3138
2.5103 2.5103 2.5564 2.5564 2.6467 2.6467 2.6470 2.6470
2.6799 2.6799 2.6821 2.6821 4.1465 4.1465 4.1535 4.1535
4.9401 4.9401 4.9402 4.9402 8.1194 8.1194 8.1308 8.1308
9.3562 9.3562 9.3567 9.3567 9.5381 9.5381 9.5412 9.5412
12.1294 12.1294 12.1297 12.1297 12.4555 12.4555
k = 0.4583 0.3608 0.3144 ( 4288 PWs) bands (ev):
-32.8715 -32.8715 -32.8715 -32.8715 -13.8992 -13.8992 -13.8991 -13.8991
-12.4884 -12.4884 -12.4881 -12.4881 -12.4543 -12.4543 -12.4542 -12.4542
2.1637 2.1637 2.2052 2.2052 2.3130 2.3130 2.3139 2.3139
2.5056 2.5056 2.5608 2.5608 2.6464 2.6464 2.6468 2.6468
2.6793 2.6793 2.6821 2.6821 4.1569 4.1569 4.1652 4.1652
4.9456 4.9456 4.9457 4.9457 8.0456 8.0456 8.0584 8.0584
9.3807 9.3807 9.3811 9.3811 9.5425 9.5425 9.5464 9.5464
12.1935 12.1935 12.1939 12.1939 12.4537 12.4537
k = 0.4514 0.3729 0.3144 ( 4286 PWs) bands (ev):
-32.8715 -32.8715 -32.8715 -32.8715 -13.8993 -13.8993 -13.8991 -13.8991
-12.4883 -12.4883 -12.4880 -12.4880 -12.4546 -12.4546 -12.4546 -12.4546
2.1622 2.1622 2.2104 2.2104 2.3131 2.3131 2.3140 2.3140
2.5011 2.5011 2.5652 2.5652 2.6460 2.6460 2.6466 2.6466
2.6788 2.6788 2.6822 2.6822 4.1694 4.1694 4.1788 4.1788
4.9517 4.9517 4.9518 4.9518 7.9664 7.9664 7.9803 7.9803
9.4025 9.4025 9.4039 9.4039 9.5491 9.5491 9.5536 9.5536
12.2560 12.2560 12.2593 12.2593 12.4515 12.4515
k = 0.4444 0.3849 0.3144 ( 4278 PWs) bands (ev):
-32.8715 -32.8715 -32.8715 -32.8715 -13.8994 -13.8994 -13.8992 -13.8992
-12.4882 -12.4882 -12.4879 -12.4879 -12.4550 -12.4550 -12.4550 -12.4550
2.1611 2.1611 2.2158 2.2158 2.3132 2.3132 2.3142 2.3142
2.4966 2.4966 2.5695 2.5695 2.6456 2.6456 2.6463 2.6463
2.6782 2.6782 2.6823 2.6823 4.1841 4.1841 4.1944 4.1944
4.9580 4.9580 4.9581 4.9581 7.8836 7.8836 7.8985 7.8985
9.4210 9.4210 9.4234 9.4234 9.5583 9.5583 9.5632 9.5632
12.2935 12.2935 12.3046 12.3046 12.4694 12.4694
k = 0.4375 0.3969 0.3144 ( 4286 PWs) bands (ev):
-32.8715 -32.8715 -32.8715 -32.8715 -13.8995 -13.8995 -13.8993 -13.8993
-12.4881 -12.4881 -12.4878 -12.4878 -12.4554 -12.4554 -12.4554 -12.4554
2.1601 2.1601 2.2213 2.2213 2.3133 2.3133 2.3143 2.3143
2.4922 2.4922 2.5737 2.5737 2.6452 2.6452 2.6460 2.6460
2.6775 2.6775 2.6824 2.6824 4.2008 4.2008 4.2120 4.2120
4.9642 4.9642 4.9644 4.9644 7.7988 7.7988 7.8146 7.8146
9.4358 9.4358 9.4389 9.4389 9.5703 9.5703 9.5753 9.5753
12.2855 12.2855 12.3010 12.3010 12.5191 12.5191
k = 0.4306 0.4090 0.3144 ( 4276 PWs) bands (ev):
-32.8714 -32.8714 -32.8714 -32.8714 -13.8997 -13.8997 -13.8994 -13.8994
-12.4881 -12.4881 -12.4876 -12.4876 -12.4559 -12.4559 -12.4558 -12.4558
2.1594 2.1594 2.2268 2.2268 2.3135 2.3135 2.3144 2.3144
2.4880 2.4880 2.5778 2.5778 2.6447 2.6447 2.6457 2.6457
2.6769 2.6769 2.6826 2.6826 4.2198 4.2198 4.2316 4.2316
4.9700 4.9700 4.9704 4.9704 7.7133 7.7133 7.7299 7.7299
9.4470 9.4470 9.4504 9.4504 9.5847 9.5847 9.5893 9.5893
12.2510 12.2510 12.2645 12.2645 12.5737 12.5737
k = 0.4236 0.4210 0.3144 ( 4280 PWs) bands (ev):
-32.8714 -32.8714 -32.8714 -32.8714 -13.8998 -13.8998 -13.8995 -13.8995
-12.4880 -12.4880 -12.4875 -12.4875 -12.4563 -12.4563 -12.4563 -12.4563
2.1589 2.1589 2.2323 2.2323 2.3137 2.3137 2.3146 2.3146
2.4838 2.4838 2.5818 2.5818 2.6442 2.6442 2.6454 2.6454
2.6762 2.6762 2.6828 2.6828 4.2408 4.2408 4.2532 4.2532
4.9748 4.9748 4.9755 4.9755 7.6284 7.6284 7.6457 7.6457
9.4552 9.4552 9.4585 9.4585 9.6007 9.6007 9.6045 9.6045
12.2069 12.2069 12.2174 12.2174 12.6161 12.6161
k = 0.4167 0.4330 0.3144 ( 4276 PWs) bands (ev):
-32.8714 -32.8714 -32.8714 -32.8714 -13.8999 -13.8999 -13.8996 -13.8996
-12.4879 -12.4879 -12.4874 -12.4874 -12.4568 -12.4568 -12.4567 -12.4567
2.1585 2.1585 2.2377 2.2377 2.3139 2.3139 2.3147 2.3147
2.4799 2.4799 2.5857 2.5857 2.6437 2.6437 2.6450 2.6450
2.6756 2.6756 2.6830 2.6830 4.2641 4.2641 4.2769 4.2769
4.9784 4.9784 4.9793 4.9793 7.5452 7.5452 7.5631 7.5631
9.4613 9.4613 9.4643 9.4643 9.6173 9.6173 9.6201 9.6201
12.1598 12.1598 12.1675 12.1675 12.6525 12.6525
k = 0.4097 0.4450 0.3144 ( 4280 PWs) bands (ev):
-32.8714 -32.8714 -32.8714 -32.8714 -13.9001 -13.9001 -13.8998 -13.8998
-12.4878 -12.4878 -12.4873 -12.4873 -12.4573 -12.4573 -12.4572 -12.4572
2.1583 2.1583 2.2429 2.2429 2.3142 2.3142 2.3148 2.3148
2.4761 2.4761 2.5894 2.5894 2.6431 2.6431 2.6446 2.6446
2.6749 2.6749 2.6833 2.6833 4.2896 4.2896 4.3026 4.3026
4.9800 4.9800 4.9813 4.9813 7.4648 7.4648 7.4831 7.4831
9.4659 9.4659 9.4686 9.4686 9.6338 9.6338 9.6354 9.6354
12.1123 12.1123 12.1179 12.1179 12.6884 12.6884
k = 0.4028 0.4571 0.3144 ( 4268 PWs) bands (ev):
-32.8714 -32.8714 -32.8714 -32.8714 -13.9002 -13.9002 -13.8999 -13.8999
-12.4878 -12.4878 -12.4872 -12.4872 -12.4577 -12.4577 -12.4576 -12.4576
2.1582 2.1582 2.2479 2.2479 2.3146 2.3146 2.3149 2.3149
2.4726 2.4726 2.5930 2.5930 2.6426 2.6426 2.6442 2.6442
2.6743 2.6743 2.6835 2.6835 4.3173 4.3173 4.3304 4.3304
4.9793 4.9793 4.9810 4.9810 7.3880 7.3880 7.4069 7.4069
9.4695 9.4695 9.4718 9.4718 9.6494 9.6494 9.6500 9.6500
12.0661 12.0661 12.0699 12.0699 12.7256 12.7256
k = 0.3958 0.4691 0.3144 ( 4278 PWs) bands (ev):
-32.8714 -32.8714 -32.8714 -32.8714 -13.9003 -13.9003 -13.9000 -13.9000
-12.4877 -12.4877 -12.4871 -12.4871 -12.4582 -12.4582 -12.4580 -12.4580
2.1582 2.1582 2.2526 2.2526 2.3149 2.3149 2.3150 2.3150
2.4693 2.4693 2.5963 2.5963 2.6421 2.6421 2.6438 2.6438
2.6737 2.6737 2.6838 2.6838 4.3473 4.3473 4.3603 4.3603
4.9755 4.9755 4.9777 4.9777 7.3159 7.3159 7.3352 7.3352
9.4726 9.4726 9.4745 9.4745 9.6634 9.6634 9.6639 9.6639
12.0221 12.0221 12.0244 12.0244 12.7646 12.7646
k = 0.3889 0.4811 0.3144 ( 4280 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9005 -13.9005 -13.9001 -13.9001
-12.4877 -12.4877 -12.4870 -12.4870 -12.4586 -12.4586 -12.4584 -12.4584
2.1583 2.1583 2.2569 2.2569 2.3150 2.3150 2.3155 2.3155
2.4663 2.4663 2.5994 2.5994 2.6416 2.6416 2.6433 2.6433
2.6732 2.6732 2.6841 2.6841 4.3795 4.3795 4.3924 4.3924
4.9680 4.9680 4.9708 4.9708 7.2494 7.2494 7.2690 7.2690
9.4755 9.4755 9.4770 9.4770 9.6753 9.6753 9.6770 9.6770
11.9812 11.9812 11.9822 11.9822 12.8055 12.8055
k = 0.3819 0.4932 0.3144 ( 4280 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9006 -13.9006 -13.9002 -13.9002
-12.4876 -12.4876 -12.4869 -12.4869 -12.4589 -12.4589 -12.4588 -12.4588
2.1585 2.1585 2.2607 2.2607 2.3150 2.3150 2.3160 2.3160
2.4637 2.4637 2.6023 2.6023 2.6411 2.6411 2.6428 2.6428
2.6728 2.6728 2.6844 2.6844 4.4141 4.4141 4.4266 4.4266
4.9563 4.9563 4.9597 4.9597 7.1892 7.1892 7.2091 7.2091
9.4782 9.4782 9.4793 9.4793 9.6857 9.6857 9.6884 9.6884
11.9437 11.9437 11.9437 11.9437 12.8485 12.8485
k = 0.3750 0.5052 0.3144 ( 4280 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9007 -13.9007 -13.9003 -13.9003
-12.4876 -12.4876 -12.4869 -12.4869 -12.4593 -12.4593 -12.4591 -12.4591
2.1587 2.1587 2.2640 2.2640 2.3151 2.3151 2.3166 2.3166
2.4613 2.4613 2.6049 2.6049 2.6407 2.6407 2.6424 2.6424
2.6724 2.6724 2.6847 2.6847 4.4510 4.4510 4.4630 4.4630
4.9398 4.9398 4.9440 4.9440 7.1362 7.1362 7.1563 7.1563
9.4809 9.4809 9.4817 9.4817 9.6944 9.6944 9.6980 9.6980
11.9094 11.9094 11.9104 11.9104 12.8935 12.8935
k = 0.3681 0.5172 0.3144 ( 4276 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9008 -13.9008 -13.9004 -13.9004
-12.4876 -12.4876 -12.4868 -12.4868 -12.4596 -12.4596 -12.4594 -12.4594
2.1589 2.1589 2.2668 2.2668 2.3151 2.3151 2.3173 2.3173
2.4594 2.4594 2.6072 2.6072 2.6403 2.6403 2.6420 2.6420
2.6721 2.6721 2.6850 2.6850 4.4902 4.4902 4.5016 4.5016
4.9180 4.9180 4.9231 4.9231 7.0908 7.0908 7.1111 7.1111
9.4837 9.4837 9.4842 9.4842 9.7014 9.7014 9.7057 9.7057
11.8798 11.8798 11.8815 11.8815 12.9405 12.9406
k = 0.3611 0.5292 0.3144 ( 4276 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9009 -13.9009 -13.9005 -13.9005
-12.4876 -12.4876 -12.4868 -12.4868 -12.4598 -12.4598 -12.4596 -12.4596
2.1591 2.1591 2.2690 2.2690 2.3151 2.3151 2.3179 2.3179
2.4578 2.4578 2.6091 2.6091 2.6400 2.6400 2.6416 2.6416
2.6719 2.6719 2.6852 2.6852 4.5318 4.5318 4.5423 4.5423
4.8907 4.8907 4.8967 4.8967 7.0536 7.0536 7.0740 7.0740
9.4865 9.4865 9.4866 9.4866 9.7065 9.7065 9.7115 9.7115
11.8552 11.8552 11.8574 11.8574 12.9894 12.9897
k = 0.3542 0.5413 0.3144 ( 4276 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9010 -13.9010 -13.9006 -13.9006
-12.4876 -12.4876 -12.4868 -12.4868 -12.4600 -12.4600 -12.4598 -12.4598
2.1592 2.1592 2.2707 2.2707 2.3152 2.3152 2.3185 2.3185
2.4566 2.4566 2.6105 2.6105 2.6398 2.6398 2.6413 2.6413
2.6718 2.6718 2.6854 2.6854 4.5756 4.5756 4.5852 4.5852
4.8576 4.8576 4.8648 4.8648 7.0248 7.0248 7.0452 7.0452
9.4890 9.4890 9.4892 9.4892 9.7100 9.7100 9.7156 9.7156
11.8358 11.8358 11.8384 11.8384 13.0400 13.0406
k = 0.3472 0.5533 0.3144 ( 4286 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9010 -13.9010 -13.9006 -13.9006
-12.4877 -12.4877 -12.4868 -12.4868 -12.4601 -12.4601 -12.4599 -12.4599
2.1593 2.1593 2.2718 2.2718 2.3152 2.3152 2.3189 2.3189
2.4557 2.4557 2.6116 2.6116 2.6396 2.6396 2.6412 2.6412
2.6717 2.6717 2.6856 2.6856 4.6218 4.6218 4.6299 4.6299
4.8189 4.8189 4.8276 4.8276 7.0044 7.0044 7.0249 7.0249
9.4912 9.4912 9.4915 9.4915 9.7121 9.7121 9.7180 9.7180
11.8219 11.8219 11.8248 11.8248 13.0920 13.0931
k = 0.3403 0.5653 0.3144 ( 4290 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9011 -13.9011 -13.9006 -13.9006
-12.4877 -12.4877 -12.4869 -12.4869 -12.4602 -12.4602 -12.4600 -12.4600
2.1594 2.1594 2.2724 2.2724 2.3152 2.3152 2.3193 2.3193
2.4552 2.4552 2.6122 2.6122 2.6395 2.6395 2.6411 2.6411
2.6716 2.6716 2.6857 2.6857 4.6697 4.6697 4.6753 4.6753
4.7752 4.7752 4.7865 4.7865 6.9924 6.9924 7.0130 7.0130
9.4928 9.4928 9.4933 9.4933 9.7129 9.7129 9.7192 9.7192
11.8135 11.8135 11.8166 11.8166 13.1439 13.1440
k = 0.3333 0.5774 0.3144 ( 4290 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9011 -13.9011 -13.9007 -13.9007
-12.4877 -12.4877 -12.4869 -12.4869 -12.4603 -12.4603 -12.4600 -12.4600
2.1594 2.1594 2.2726 2.2726 2.3152 2.3152 2.3194 2.3194
2.4551 2.4551 2.6124 2.6124 2.6394 2.6394 2.6410 2.6410
2.6716 2.6716 2.6857 2.6857 4.7068 4.7068 4.7085 4.7085
4.7377 4.7377 4.7564 4.7564 6.9885 6.9885 7.0091 7.0091
9.4934 9.4934 9.4940 9.4940 9.7130 9.7130 9.7194 9.7194
11.8107 11.8107 11.8139 11.8139 13.1793 13.1793
k = 0.3333 0.5774 0.3144 ( 4290 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9011 -13.9011 -13.9007 -13.9007
-12.4877 -12.4877 -12.4869 -12.4869 -12.4603 -12.4603 -12.4600 -12.4600
2.1594 2.1594 2.2726 2.2726 2.3152 2.3152 2.3194 2.3194
2.4551 2.4551 2.6124 2.6124 2.6394 2.6394 2.6410 2.6410
2.6716 2.6716 2.6857 2.6857 4.7068 4.7068 4.7085 4.7085
4.7377 4.7377 4.7564 4.7564 6.9885 6.9885 7.0091 7.0091
9.4934 9.4934 9.4940 9.4940 9.7130 9.7130 9.7194 9.7194
11.8107 11.8107 11.8139 11.8139 13.1793 13.1793
k = 0.3262 0.5651 0.3144 ( 4286 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9011 -13.9011 -13.9006 -13.9006
-12.4877 -12.4877 -12.4868 -12.4868 -12.4602 -12.4602 -12.4600 -12.4600
2.1594 2.1594 2.2724 2.2724 2.3152 2.3152 2.3192 2.3192
2.4552 2.4552 2.6122 2.6122 2.6395 2.6395 2.6410 2.6410
2.6716 2.6716 2.6857 2.6857 4.6650 4.6650 4.6710 4.6710
4.7800 4.7800 4.7909 4.7909 6.9924 6.9924 7.0130 7.0130
9.4926 9.4926 9.4930 9.4930 9.7131 9.7131 9.7194 9.7194
11.8136 11.8136 11.8167 11.8167 13.1388 13.1388
k = 0.3191 0.5528 0.3144 ( 4290 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9010 -13.9010 -13.9006 -13.9006
-12.4876 -12.4876 -12.4868 -12.4868 -12.4602 -12.4602 -12.4599 -12.4599
2.1593 2.1593 2.2719 2.2719 2.3151 2.3151 2.3188 2.3188
2.4556 2.4556 2.6116 2.6116 2.6396 2.6396 2.6411 2.6411
2.6716 2.6716 2.6855 2.6855 4.6053 4.6053 4.6139 4.6139
4.8366 4.8366 4.8448 4.8448 7.0038 7.0038 7.0243 7.0243
9.4894 9.4894 9.4897 9.4897 9.7140 9.7140 9.7199 9.7199
11.8219 11.8219 11.8248 11.8248 13.0734 13.0735
k = 0.3121 0.5405 0.3144 ( 4286 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9009 -13.9009 -13.9005 -13.9005
-12.4876 -12.4876 -12.4868 -12.4868 -12.4600 -12.4600 -12.4598 -12.4598
2.1591 2.1591 2.2710 2.2710 2.3151 2.3151 2.3182 2.3182
2.4562 2.4562 2.6108 2.6108 2.6398 2.6398 2.6410 2.6410
2.6715 2.6715 2.6853 2.6853 4.5410 4.5410 4.5511 4.5511
4.8964 4.8964 4.9030 4.9030 7.0219 7.0219 7.0425 7.0425
9.4833 9.4833 9.4834 9.4834 9.7164 9.7164 9.7218 9.7218
11.8352 11.8352 11.8379 11.8379 13.0014 13.0014
k = 0.3050 0.5282 0.3144 ( 4290 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9008 -13.9008 -13.9004 -13.9004
-12.4875 -12.4875 -12.4867 -12.4867 -12.4599 -12.4599 -12.4597 -12.4597
2.1589 2.1589 2.2699 2.2699 2.3150 2.3150 2.3172 2.3172
2.4569 2.4569 2.6096 2.6096 2.6400 2.6400 2.6409 2.6409
2.6714 2.6714 2.6849 2.6849 4.4732 4.4732 4.4845 4.4845
4.9589 4.9589 4.9642 4.9642 7.0462 7.0462 7.0668 7.0668
9.4734 9.4734 9.4738 9.4738 9.7211 9.7211 9.7259 9.7259
11.8527 11.8527 11.8551 11.8551 12.9259 12.9259
k = 0.2979 0.5159 0.3144 ( 4292 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9007 -13.9007 -13.9003 -13.9003
-12.4873 -12.4873 -12.4866 -12.4866 -12.4597 -12.4597 -12.4595 -12.4595
2.1585 2.1585 2.2685 2.2685 2.3149 2.3149 2.3160 2.3160
2.4577 2.4577 2.6083 2.6083 2.6403 2.6403 2.6407 2.6407
2.6711 2.6711 2.6843 2.6843 4.4027 4.4027 4.4150 4.4150
5.0242 5.0242 5.0282 5.0282 7.0760 7.0760 7.0967 7.0967
9.4595 9.4595 9.4604 9.4604 9.7286 9.7286 9.7327 9.7327
11.8735 11.8735 11.8756 11.8756 12.8491 12.8491
k = 0.2908 0.5036 0.3144 ( 4292 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9005 -13.9005 -13.9002 -13.9002
-12.4871 -12.4871 -12.4864 -12.4864 -12.4594 -12.4594 -12.4592 -12.4592
2.1581 2.1581 2.2668 2.2668 2.3145 2.3145 2.3148 2.3148
2.4585 2.4585 2.6068 2.6068 2.6404 2.6404 2.6406 2.6406
2.6706 2.6706 2.6836 2.6836 4.3301 4.3301 4.3433 4.3433
5.0920 5.0920 5.0949 5.0949 7.1107 7.1107 7.1315 7.1315
9.4417 9.4417 9.4430 9.4430 9.7392 9.7392 9.7425 9.7425
11.8959 11.8959 11.8975 11.8975 12.7733 12.7733
k = 0.2837 0.4914 0.3144 ( 4280 PWs) bands (ev):
-32.8714 -32.8714 -32.8714 -32.8714 -13.9003 -13.9003 -13.9000 -13.9000
-12.4868 -12.4868 -12.4861 -12.4861 -12.4592 -12.4592 -12.4590 -12.4590
2.1576 2.1576 2.2651 2.2651 2.3127 2.3127 2.3146 2.3146
2.4593 2.4593 2.6051 2.6051 2.6399 2.6399 2.6410 2.6410
2.6700 2.6700 2.6828 2.6828 4.2560 4.2560 4.2700 4.2700
5.1625 5.1625 5.1643 5.1643 7.1498 7.1498 7.1707 7.1707
9.4202 9.4202 9.4220 9.4220 9.7528 9.7528 9.7554 9.7554
11.9173 11.9173 11.9186 11.9186 12.7016 12.7016
k = 0.2766 0.4791 0.3144 ( 4270 PWs) bands (ev):
-32.8714 -32.8714 -32.8714 -32.8714 -13.9001 -13.9001 -13.8997 -13.8997
-12.4865 -12.4865 -12.4858 -12.4858 -12.4589 -12.4589 -12.4587 -12.4587
2.1571 2.1571 2.2631 2.2631 2.3108 2.3108 2.3143 2.3143
2.4601 2.4601 2.6034 2.6034 2.6392 2.6392 2.6414 2.6414
2.6693 2.6693 2.6817 2.6817 4.1809 4.1809 4.1957 4.1957
5.2356 5.2356 5.2363 5.2363 7.1926 7.1926 7.2137 7.2137
9.3955 9.3955 9.3976 9.3976 9.7692 9.7692 9.7712 9.7712
11.9341 11.9341 11.9353 11.9353 12.6382 12.6382
k = 0.2695 0.4668 0.3144 ( 4266 PWs) bands (ev):
-32.8714 -32.8714 -32.8714 -32.8714 -13.8998 -13.8998 -13.8995 -13.8995
-12.4861 -12.4861 -12.4855 -12.4855 -12.4586 -12.4586 -12.4584 -12.4584
2.1564 2.1564 2.2610 2.2610 2.3085 2.3085 2.3140 2.3140
2.4607 2.4607 2.6015 2.6015 2.6383 2.6383 2.6418 2.6418
2.6683 2.6683 2.6804 2.6804 4.1053 4.1053 4.1208 4.1208
5.3109 5.3109 5.3113 5.3113 7.2388 7.2388 7.2601 7.2601
9.3680 9.3680 9.3703 9.3703 9.7883 9.7883 9.7898 9.7898
11.9414 11.9414 11.9428 11.9428 12.5885 12.5885
k = 0.2624 0.4545 0.3144 ( 4266 PWs) bands (ev):
-32.8715 -32.8715 -32.8715 -32.8715 -13.8995 -13.8995 -13.8992 -13.8992
-12.4856 -12.4856 -12.4850 -12.4850 -12.4583 -12.4583 -12.4581 -12.4581
2.1557 2.1557 2.2587 2.2587 2.3061 2.3061 2.3135 2.3135
2.4612 2.4612 2.5995 2.5995 2.6371 2.6371 2.6423 2.6423
2.6671 2.6671 2.6789 2.6789 4.0297 4.0297 4.0457 4.0457
5.3881 5.3881 5.3895 5.3895 7.2879 7.2879 7.3094 7.3094
9.3380 9.3380 9.3405 9.3405 9.8098 9.8098 9.8108 9.8108
11.9335 11.9335 11.9356 11.9356 12.5581 12.5581
k = 0.2553 0.4422 0.3144 ( 4270 PWs) bands (ev):
-32.8715 -32.8715 -32.8715 -32.8715 -13.8992 -13.8992 -13.8989 -13.8989
-12.4851 -12.4851 -12.4845 -12.4845 -12.4579 -12.4579 -12.4578 -12.4578
2.1549 2.1549 2.2562 2.2562 2.3034 2.3034 2.3130 2.3130
2.4615 2.4615 2.5974 2.5974 2.6355 2.6355 2.6427 2.6427
2.6657 2.6657 2.6771 2.6771 3.9544 3.9544 3.9710 3.9710
5.4680 5.4680 5.4704 5.4704 7.3396 7.3396 7.3611 7.3611
9.3060 9.3060 9.3087 9.3087 9.8334 9.8334 9.8340 9.8340
11.9068 11.9068 11.9102 11.9102 12.5510 12.5510
k = 0.2482 0.4299 0.3144 ( 4270 PWs) bands (ev):
-32.8716 -32.8716 -32.8716 -32.8716 -13.8988 -13.8988 -13.8985 -13.8985
-12.4844 -12.4844 -12.4839 -12.4839 -12.4576 -12.4576 -12.4575 -12.4575
2.1539 2.1539 2.2536 2.2536 2.3006 2.3006 2.3123 2.3123
2.4617 2.4617 2.5952 2.5952 2.6336 2.6336 2.6431 2.6431
2.6641 2.6641 2.6751 2.6751 3.8798 3.8798 3.8968 3.8968
5.5505 5.5505 5.5538 5.5538 7.3933 7.3933 7.4151 7.4151
9.2725 9.2725 9.2753 9.2753 9.8591 9.8591 9.8594 9.8594
11.8618 11.8618 11.8666 11.8666 12.5668 12.5668
k = 0.2411 0.4177 0.3144 ( 4272 PWs) bands (ev):
-32.8716 -32.8716 -32.8716 -32.8716 -13.8984 -13.8984 -13.8981 -13.8981
-12.4837 -12.4837 -12.4832 -12.4832 -12.4573 -12.4573 -12.4572 -12.4572
2.1529 2.1529 2.2508 2.2508 2.2974 2.2974 2.3114 2.3114
2.4617 2.4617 2.5929 2.5929 2.6313 2.6313 2.6435 2.6435
2.6625 2.6625 2.6727 2.6727 3.8062 3.8062 3.8237 3.8237
5.6355 5.6355 5.6397 5.6397 7.4490 7.4490 7.4709 7.4709
9.2376 9.2376 9.2405 9.2405 9.8865 9.8865 9.8866 9.8866
11.8023 11.8023 11.8085 11.8085 12.6015 12.6015
k = 0.2340 0.4054 0.3144 ( 4280 PWs) bands (ev):
-32.8717 -32.8717 -32.8717 -32.8717 -13.8980 -13.8980 -13.8977 -13.8977
-12.4829 -12.4829 -12.4824 -12.4824 -12.4569 -12.4569 -12.4569 -12.4569
2.1517 2.1517 2.2478 2.2478 2.2941 2.2941 2.3104 2.3104
2.4615 2.4615 2.5906 2.5906 2.6284 2.6284 2.6439 2.6439
2.6608 2.6608 2.6701 2.6701 3.7340 3.7340 3.7518 3.7518
5.7231 5.7231 5.7281 5.7281 7.5061 7.5061 7.5282 7.5282
9.2017 9.2017 9.2047 9.2047 9.9155 9.9155 9.9156 9.9156
11.7330 11.7330 11.7405 11.7405 12.6502 12.6502
k = 0.2270 0.3931 0.3144 ( 4284 PWs) bands (ev):
-32.8717 -32.8717 -32.8717 -32.8717 -13.8975 -13.8975 -13.8972 -13.8972
-12.4820 -12.4820 -12.4816 -12.4816 -12.4566 -12.4566 -12.4566 -12.4566
2.1504 2.1504 2.2446 2.2446 2.2906 2.2906 2.3092 2.3092
2.4612 2.4612 2.5881 2.5881 2.6250 2.6250 2.6442 2.6442
2.6591 2.6591 2.6672 2.6672 3.6635 3.6635 3.6815 3.6815
5.8132 5.8132 5.8191 5.8191 7.5646 7.5646 7.5867 7.5867
9.1651 9.1651 9.1683 9.1683 9.9459 9.9459 9.9461 9.9461
11.6580 11.6580 11.6666 11.6666 12.7085 12.7085
k = 0.2199 0.3808 0.3144 ( 4280 PWs) bands (ev):
-32.8718 -32.8718 -32.8718 -32.8718 -13.8970 -13.8970 -13.8967 -13.8967
-12.4811 -12.4811 -12.4807 -12.4807 -12.4563 -12.4563 -12.4562 -12.4562
2.1490 2.1490 2.2411 2.2411 2.2868 2.2868 2.3078 2.3078
2.4606 2.4606 2.5855 2.5855 2.6209 2.6209 2.6444 2.6444
2.6575 2.6575 2.6641 2.6641 3.5949 3.5949 3.6130 3.6130
5.9059 5.9059 5.9125 5.9125 7.6241 7.6241 7.6463 7.6463
9.1280 9.1280 9.1313 9.1313 9.9776 9.9776 9.9780 9.9780
11.5799 11.5799 11.5895 11.5895 12.7732 12.7732
k = 0.2128 0.3685 0.3144 ( 4288 PWs) bands (ev):
-32.8719 -32.8719 -32.8719 -32.8719 -13.8964 -13.8964 -13.8962 -13.8962
-12.4801 -12.4801 -12.4797 -12.4797 -12.4560 -12.4560 -12.4559 -12.4559
2.1474 2.1474 2.2373 2.2373 2.2829 2.2829 2.3062 2.3062
2.4599 2.4599 2.5827 2.5827 2.6161 2.6161 2.6444 2.6444
2.6560 2.6560 2.6607 2.6607 3.5284 3.5284 3.5467 3.5467
6.0010 6.0010 6.0083 6.0083 7.6843 7.6843 7.7066 7.7066
9.0907 9.0907 9.0942 9.0942 10.0106 10.0106 10.0110 10.0110
11.5008 11.5008 11.5113 11.5113 12.8412 12.8412
k = 0.2057 0.3562 0.3144 ( 4280 PWs) bands (ev):
-32.8719 -32.8719 -32.8719 -32.8719 -13.8959 -13.8959 -13.8957 -13.8957
-12.4789 -12.4789 -12.4786 -12.4786 -12.4557 -12.4557 -12.4556 -12.4556
2.1455 2.1455 2.2331 2.2331 2.2788 2.2788 2.3043 2.3043
2.4590 2.4590 2.5796 2.5796 2.6107 2.6107 2.6441 2.6441
2.6547 2.6547 2.6573 2.6573 3.4645 3.4645 3.4826 3.4826
6.0986 6.0986 6.1066 6.1066 7.7451 7.7451 7.7674 7.7674
9.0534 9.0534 9.0572 9.0572 10.0445 10.0445 10.0450 10.0450
11.4219 11.4219 11.4332 11.4332 12.9102 12.9102
k = 0.1986 0.3440 0.3144 ( 4280 PWs) bands (ev):
-32.8720 -32.8720 -32.8720 -32.8720 -13.8953 -13.8953 -13.8951 -13.8951
-12.4778 -12.4778 -12.4775 -12.4775 -12.4554 -12.4554 -12.4553 -12.4553
2.1434 2.1434 2.2282 2.2282 2.2746 2.2746 2.3021 2.3021
2.4579 2.4579 2.5760 2.5760 2.6048 2.6048 2.6431 2.6431
2.6535 2.6535 2.6541 2.6541 3.4032 3.4032 3.4211 3.4211
6.1986 6.1986 6.2072 6.2072 7.8061 7.8061 7.8284 7.8284
9.0164 9.0164 9.0204 9.0204 10.0793 10.0793 10.0797 10.0797
11.3442 11.3442 11.3564 11.3564 12.9774 12.9774
k = 0.1915 0.3317 0.3144 ( 4264 PWs) bands (ev):
-32.8721 -32.8721 -32.8721 -32.8721 -13.8947 -13.8947 -13.8945 -13.8945
-12.4765 -12.4765 -12.4762 -12.4762 -12.4550 -12.4550 -12.4550 -12.4550
2.1410 2.1410 2.2227 2.2227 2.2705 2.2705 2.2996 2.2996
2.4566 2.4566 2.5718 2.5718 2.5987 2.5987 2.6409 2.6409
2.6518 2.6518 2.6525 2.6525 3.3449 3.3449 3.3624 3.3624
6.3010 6.3010 6.3102 6.3102 7.8672 7.8672 7.8893 7.8893
8.9799 8.9799 8.9843 8.9843 10.1148 10.1148 10.1151 10.1151
11.2685 11.2685 11.2814 11.2814 13.0399 13.0399
k = 0.1844 0.3194 0.3144 ( 4260 PWs) bands (ev):
-32.8722 -32.8722 -32.8722 -32.8722 -13.8940 -13.8940 -13.8939 -13.8939
-12.4752 -12.4752 -12.4750 -12.4750 -12.4548 -12.4548 -12.4548 -12.4548
2.1382 2.1382 2.2163 2.2163 2.2663 2.2663 2.2968 2.2968
2.4552 2.4552 2.5664 2.5664 2.5927 2.5927 2.6372 2.6372
2.6506 2.6506 2.6516 2.6516 3.2898 3.2898 3.3067 3.3067
6.4057 6.4057 6.4154 6.4154 7.9278 7.9278 7.9497 7.9497
8.9443 8.9443 8.9492 8.9492 10.1507 10.1507 10.1508 10.1508
11.1952 11.1952 11.2088 11.2088 13.0943 13.0944
k = 0.1773 0.3071 0.3144 ( 4266 PWs) bands (ev):
-32.8723 -32.8723 -32.8723 -32.8723 -13.8934 -13.8934 -13.8932 -13.8932
-12.4739 -12.4739 -12.4737 -12.4737 -12.4545 -12.4545 -12.4545 -12.4545
2.1349 2.1349 2.2089 2.2089 2.2623 2.2623 2.2936 2.2936
2.4535 2.4535 2.5596 2.5596 2.5873 2.5873 2.6325 2.6325
2.6500 2.6500 2.6509 2.6509 3.2379 3.2379 3.2542 3.2542
6.5127 6.5127 6.5229 6.5229 7.9877 7.9877 8.0092 8.0092
8.9099 8.9099 8.9153 8.9153 10.1867 10.1867 10.1868 10.1868
11.1247 11.1247 11.1391 11.1391 13.1375 13.1377
k = 0.1702 0.2948 0.3144 ( 4262 PWs) bands (ev):
-32.8723 -32.8723 -32.8723 -32.8723 -13.8927 -13.8927 -13.8926 -13.8926
-12.4725 -12.4725 -12.4723 -12.4723 -12.4542 -12.4542 -12.4542 -12.4542
2.1310 2.1310 2.2004 2.2004 2.2584 2.2584 2.2900 2.2900
2.4517 2.4517 2.5511 2.5511 2.5828 2.5828 2.6270 2.6270
2.6499 2.6499 2.6503 2.6503 3.1896 3.1896 3.2049 3.2049
6.6219 6.6219 6.6325 6.6325 8.0464 8.0464 8.0674 8.0674
8.8771 8.8771 8.8833 8.8833 10.2226 10.2226 10.2229 10.2229
11.0575 11.0575 11.0726 11.0726 13.1668 13.1671
k = 0.1631 0.2825 0.3144 ( 4266 PWs) bands (ev):
-32.8724 -32.8724 -32.8724 -32.8724 -13.8921 -13.8921 -13.8919 -13.8919
-12.4711 -12.4711 -12.4709 -12.4709 -12.4540 -12.4540 -12.4539 -12.4539
2.1265 2.1265 2.1906 2.1906 2.2548 2.2548 2.2860 2.2860
2.4498 2.4498 2.5413 2.5413 2.5789 2.5789 2.6211 2.6211
2.6499 2.6499 2.6499 2.6499 3.1449 3.1449 3.1591 3.1591
6.7332 6.7332 6.7443 6.7443 8.1032 8.1032 8.1234 8.1234
8.8466 8.8466 8.8537 8.8537 10.2583 10.2583 10.2589 10.2589
10.9938 10.9938 11.0097 11.0097 13.1808 13.1826
k = 0.1560 0.2702 0.3144 ( 4274 PWs) bands (ev):
-32.8725 -32.8725 -32.8725 -32.8725 -13.8914 -13.8914 -13.8913 -13.8913
-12.4696 -12.4696 -12.4695 -12.4695 -12.4537 -12.4537 -12.4537 -12.4537
2.1211 2.1211 2.1794 2.1794 2.2514 2.2514 2.2816 2.2816
2.4476 2.4476 2.5305 2.5305 2.5756 2.5756 2.6150 2.6150
2.6495 2.6495 2.6499 2.6499 3.1038 3.1038 3.1167 3.1167
6.8467 6.8467 6.8580 6.8580 8.1573 8.1573 8.1764 8.1764
8.8191 8.8191 8.8274 8.8274 10.2935 10.2935 10.2945 10.2945
10.9339 10.9339 10.9505 10.9505 13.1795 13.1810
k = 0.1489 0.2580 0.3144 ( 4274 PWs) bands (ev):
-32.8726 -32.8726 -32.8726 -32.8726 -13.8907 -13.8907 -13.8906 -13.8906
-12.4682 -12.4682 -12.4681 -12.4681 -12.4534 -12.4534 -12.4534 -12.4534
2.1148 2.1148 2.1669 2.1669 2.2483 2.2483 2.2768 2.2768
2.4454 2.4454 2.5190 2.5190 2.5726 2.5726 2.6086 2.6086
2.6493 2.6493 2.6501 2.6501 3.0663 3.0663 3.0779 3.0779
6.9621 6.9621 6.9738 6.9738 8.2076 8.2076 8.2252 8.2252
8.7957 8.7957 8.8055 8.8055 10.3280 10.3280 10.3294 10.3294
10.8780 10.8780 10.8953 10.8953 13.1644 13.1647
k = 0.1418 0.2457 0.3144 ( 4274 PWs) bands (ev):
-32.8727 -32.8727 -32.8727 -32.8727 -13.8901 -13.8901 -13.8900 -13.8900
-12.4668 -12.4668 -12.4667 -12.4667 -12.4532 -12.4532 -12.4531 -12.4531
2.1074 2.1074 2.1531 2.1531 2.2454 2.2454 2.2718 2.2718
2.4430 2.4430 2.5073 2.5073 2.5699 2.5699 2.6022 2.6022
2.6492 2.6492 2.6503 2.6503 3.0324 3.0324 3.0426 3.0426
7.0794 7.0794 7.0914 7.0914 8.2526 8.2526 8.2683 8.2683
8.7776 8.7776 8.7893 8.7893 10.3615 10.3615 10.3635 10.3635
10.8263 10.8263 10.8443 10.8443 13.1376 13.1376
k = 0.1348 0.2334 0.3144 ( 4276 PWs) bands (ev):
-32.8728 -32.8728 -32.8728 -32.8728 -13.8894 -13.8894 -13.8893 -13.8893
-12.4653 -12.4653 -12.4653 -12.4653 -12.4529 -12.4529 -12.4528 -12.4528
2.0988 2.0988 2.1381 2.1381 2.2428 2.2428 2.2666 2.2666
2.4405 2.4405 2.4956 2.4956 2.5674 2.5674 2.5959 2.5959
2.6492 2.6492 2.6505 2.6505 3.0019 3.0019 3.0106 3.0106
7.1984 7.1984 7.2107 7.2107 8.2905 8.2905 8.3038 8.3038
8.7667 8.7667 8.7807 8.7807 10.3938 10.3938 10.3966 10.3966
10.7789 10.7789 10.7978 10.7978 13.1010 13.1015
k = 0.1277 0.2211 0.3144 ( 4264 PWs) bands (ev):
-32.8729 -32.8729 -32.8729 -32.8729 -13.8887 -13.8887 -13.8887 -13.8887
-12.4639 -12.4639 -12.4639 -12.4639 -12.4526 -12.4526 -12.4525 -12.4525
2.0889 2.0889 2.1219 2.1219 2.2403 2.2403 2.2613 2.2613
2.4380 2.4380 2.4844 2.4844 2.5651 2.5651 2.5897 2.5897
2.6493 2.6493 2.6507 2.6507 2.9746 2.9746 2.9819 2.9819
7.3191 7.3191 7.3316 7.3316 8.3195 8.3195 8.3301 8.3301
8.7645 8.7645 8.7811 8.7811 10.4247 10.4247 10.4283 10.4283
10.7362 10.7362 10.7558 10.7558 13.0562 13.0563
k = 0.1206 0.2088 0.3144 ( 4260 PWs) bands (ev):
-32.8730 -32.8730 -32.8730 -32.8730 -13.8881 -13.8881 -13.8880 -13.8880
-12.4626 -12.4626 -12.4626 -12.4626 -12.4523 -12.4523 -12.4522 -12.4522
2.0776 2.0776 2.1048 2.1048 2.2381 2.2381 2.2561 2.2561
2.4354 2.4354 2.4739 2.4739 2.5629 2.5629 2.5838 2.5838
2.6495 2.6495 2.6510 2.6510 2.9503 2.9503 2.9563 2.9563
7.4413 7.4413 7.4540 7.4540 8.3383 8.3383 8.3463 8.3463
8.7721 8.7721 8.7912 8.7912 10.4539 10.4539 10.4586 10.4586
10.6981 10.6981 10.7187 10.7187 13.0039 13.0041
k = 0.1135 0.1965 0.3144 ( 4264 PWs) bands (ev):
-32.8730 -32.8730 -32.8730 -32.8730 -13.8874 -13.8874 -13.8874 -13.8874
-12.4613 -12.4613 -12.4613 -12.4613 -12.4519 -12.4519 -12.4518 -12.4518
2.0651 2.0651 2.0870 2.0870 2.2359 2.2359 2.2511 2.2511
2.4328 2.4328 2.4641 2.4641 2.5607 2.5607 2.5783 2.5783
2.6498 2.6498 2.6513 2.6513 2.9287 2.9287 2.9335 2.9335
7.5648 7.5648 7.5776 7.5776 8.3470 8.3470 8.3527 8.3527
8.7894 8.7894 8.8104 8.8104 10.4811 10.4811 10.4871 10.4871
10.6649 10.6649 10.6866 10.6866 12.9441 12.9442
k = 0.1064 0.1843 0.3144 ( 4256 PWs) bands (ev):
-32.8731 -32.8731 -32.8731 -32.8731 -13.8868 -13.8868 -13.8868 -13.8868
-12.4602 -12.4602 -12.4602 -12.4602 -12.4515 -12.4515 -12.4514 -12.4514
2.0513 2.0513 2.0686 2.0686 2.2340 2.2340 2.2465 2.2465
2.4303 2.4303 2.4553 2.4553 2.5587 2.5587 2.5731 2.5731
2.6502 2.6502 2.6516 2.6516 2.9095 2.9095 2.9133 2.9133
7.6893 7.6893 7.7022 7.7022 8.3471 8.3471 8.3510 8.3510
8.8146 8.8146 8.8369 8.8369 10.5059 10.5059 10.5137 10.5137
10.6368 10.6368 10.6599 10.6599 12.8761 12.8802
k = 0.0993 0.1720 0.3144 ( 4260 PWs) bands (ev):
-32.8732 -32.8732 -32.8732 -32.8732 -13.8862 -13.8862 -13.8862 -13.8862
-12.4591 -12.4591 -12.4591 -12.4591 -12.4510 -12.4510 -12.4510 -12.4510
2.0367 2.0367 2.0500 2.0500 2.2321 2.2321 2.2421 2.2421
2.4278 2.4278 2.4474 2.4474 2.5567 2.5567 2.5683 2.5683
2.6506 2.6506 2.6519 2.6519 2.8925 2.8925 2.8954 2.8954
7.8145 7.8145 7.8276 7.8276 8.3405 8.3405 8.3433 8.3433
8.8455 8.8455 8.8683 8.8683 10.5276 10.5276 10.5380 10.5380
10.6139 10.6139 10.6390 10.6390 12.7983 12.7986
k = 0.0922 0.1597 0.3144 ( 4262 PWs) bands (ev):
-32.8733 -32.8733 -32.8733 -32.8733 -13.8857 -13.8857 -13.8856 -13.8856
-12.4582 -12.4582 -12.4582 -12.4582 -12.4505 -12.4505 -12.4504 -12.4504
2.0213 2.0213 2.0315 2.0315 2.2304 2.2304 2.2383 2.2383
2.4253 2.4253 2.4404 2.4404 2.5548 2.5548 2.5640 2.5640
2.6511 2.6511 2.6523 2.6523 2.8775 2.8775 2.8796 2.8796
7.9402 7.9402 7.9534 7.9534 8.3296 8.3296 8.3318 8.3318
8.8796 8.8796 8.9024 8.9024 10.5453 10.5453 10.5589 10.5589
10.5972 10.5972 10.6249 10.6249 12.7093 12.7093
k = 0.0851 0.1474 0.3144 ( 4262 PWs) bands (ev):
-32.8734 -32.8734 -32.8734 -32.8734 -13.8851 -13.8851 -13.8851 -13.8851
-12.4574 -12.4574 -12.4574 -12.4574 -12.4499 -12.4499 -12.4498 -12.4498
2.0056 2.0056 2.0131 2.0131 2.2288 2.2288 2.2349 2.2349
2.4230 2.4230 2.4344 2.4344 2.5531 2.5531 2.5602 2.5602
2.6517 2.6517 2.6527 2.6527 2.8642 2.8642 2.8658 2.8658
8.0657 8.0657 8.0791 8.0791 8.3160 8.3160 8.3180 8.3180
8.9150 8.9150 8.9373 8.9373 10.5573 10.5573 10.5705 10.5705
10.5925 10.5925 10.6188 10.6188 12.6081 12.6087
k = 0.0780 0.1351 0.3144 ( 4266 PWs) bands (ev):
-32.8734 -32.8734 -32.8734 -32.8734 -13.8846 -13.8846 -13.8846 -13.8846
-12.4568 -12.4568 -12.4568 -12.4568 -12.4492 -12.4492 -12.4492 -12.4492
1.9899 1.9899 1.9954 1.9954 2.2274 2.2274 2.2319 2.2319
2.4208 2.4208 2.4293 2.4293 2.5514 2.5514 2.5568 2.5568
2.6523 2.6523 2.6532 2.6532 2.8525 2.8525 2.8536 2.8536
8.1898 8.1898 8.2041 8.2041 8.3014 8.3014 8.3041 8.3041
8.9501 8.9501 8.9716 8.9716 10.5633 10.5633 10.5676 10.5676
10.6046 10.6046 10.6210 10.6210 12.4955 12.4958
k = 0.0709 0.1228 0.3144 ( 4262 PWs) bands (ev):
-32.8735 -32.8735 -32.8735 -32.8735 -13.8841 -13.8841 -13.8841 -13.8841
-12.4563 -12.4563 -12.4562 -12.4562 -12.4485 -12.4485 -12.4485 -12.4485
1.9745 1.9745 1.9784 1.9784 2.2260 2.2260 2.2293 2.2293
2.4187 2.4187 2.4249 2.4249 2.5498 2.5498 2.5538 2.5538
2.6529 2.6529 2.6536 2.6536 2.8422 2.8422 2.8429 2.8429
8.2788 8.2788 8.2844 8.2844 8.3238 8.3238 8.3299 8.3299
8.9839 8.9839 9.0043 9.0043 10.5645 10.5645 10.5660 10.5660
10.6189 10.6189 10.6281 10.6281 12.3746 12.3762
k = 0.0638 0.1106 0.3144 ( 4262 PWs) bands (ev):
-32.8735 -32.8735 -32.8735 -32.8735 -13.8837 -13.8837 -13.8837 -13.8837
-12.4558 -12.4558 -12.4558 -12.4558 -12.4478 -12.4478 -12.4477 -12.4477
1.9597 1.9597 1.9624 1.9624 2.2248 2.2248 2.2271 2.2271
2.4168 2.4168 2.4212 2.4212 2.5483 2.5483 2.5512 2.5512
2.6535 2.6535 2.6541 2.6541 2.8332 2.8332 2.8337 2.8337
8.2693 8.2693 8.2701 8.2701 8.4406 8.4406 8.4512 8.4512
9.0156 9.0156 9.0346 9.0346 10.5645 10.5645 10.5689 10.5689
10.6313 10.6313 10.6364 10.6364 12.2493 12.2494
k = 0.0567 0.0983 0.3144 ( 4266 PWs) bands (ev):
-32.8736 -32.8736 -32.8736 -32.8736 -13.8833 -13.8833 -13.8833 -13.8833
-12.4555 -12.4555 -12.4555 -12.4555 -12.4470 -12.4470 -12.4470 -12.4470
1.9458 1.9458 1.9475 1.9475 2.2237 2.2237 2.2253 2.2253
2.4151 2.4151 2.4180 2.4180 2.5470 2.5470 2.5490 2.5490
2.6542 2.6542 2.6546 2.6546 2.8253 2.8253 2.8256 2.8256
8.2555 8.2555 8.2559 8.2559 8.5594 8.5594 8.5701 8.5701
9.0446 9.0446 9.0620 9.0620 10.5678 10.5678 10.5733 10.5733
10.6412 10.6412 10.6436 10.6436 12.1234 12.1236
k = 0.0496 0.0860 0.3144 ( 4262 PWs) bands (ev):
-32.8736 -32.8736 -32.8736 -32.8736 -13.8829 -13.8829 -13.8829 -13.8829
-12.4553 -12.4553 -12.4553 -12.4553 -12.4464 -12.4464 -12.4463 -12.4463
1.9330 1.9330 1.9341 1.9341 2.2227 2.2227 2.2237 2.2237
2.4135 2.4135 2.4154 2.4154 2.5458 2.5458 2.5471 2.5471
2.6548 2.6548 2.6551 2.6551 2.8185 2.8185 2.8187 2.8187
8.2425 8.2425 8.2426 8.2426 8.6743 8.6743 8.6847 8.6847
9.0706 9.0706 9.0861 9.0861 10.5737 10.5737 10.5794 10.5794
10.6484 10.6484 10.6490 10.6490 12.0010 12.0011
k = 0.0426 0.0737 0.3144 ( 4270 PWs) bands (ev):
-32.8737 -32.8737 -32.8737 -32.8737 -13.8826 -13.8826 -13.8826 -13.8826
-12.4551 -12.4551 -12.4551 -12.4551 -12.4457 -12.4457 -12.4457 -12.4457
1.9214 1.9214 1.9221 1.9221 2.2218 2.2218 2.2225 2.2225
2.4122 2.4122 2.4133 2.4133 2.5447 2.5447 2.5455 2.5455
2.6553 2.6553 2.6555 2.6555 2.8127 2.8127 2.8128 2.8128
8.2307 8.2307 8.2307 8.2307 8.7833 8.7833 8.7932 8.7932
9.0934 9.0934 9.1069 9.1069 10.5813 10.5813 10.5867 10.5867
10.6522 10.6522 10.6527 10.6527 11.8855 11.8856
k = 0.0355 0.0614 0.3144 ( 4280 PWs) bands (ev):
-32.8737 -32.8737 -32.8737 -32.8737 -13.8824 -13.8824 -13.8824 -13.8824
-12.4549 -12.4549 -12.4549 -12.4549 -12.4452 -12.4452 -12.4452 -12.4452
1.9114 1.9114 1.9118 1.9118 2.2211 2.2211 2.2214 2.2214
2.4110 2.4110 2.4116 2.4116 2.5438 2.5438 2.5442 2.5442
2.6558 2.6558 2.6560 2.6560 2.8078 2.8078 2.8079 2.8079
8.2204 8.2204 8.2204 8.2204 8.8842 8.8842 8.8932 8.8932
9.1127 9.1127 9.1242 9.1242 10.5897 10.5897 10.5942 10.5942
10.6531 10.6531 10.6544 10.6544 11.7802 11.7803
k = 0.0284 0.0491 0.3144 ( 4288 PWs) bands (ev):
-32.8738 -32.8738 -32.8738 -32.8738 -13.8821 -13.8821 -13.8821 -13.8821
-12.4548 -12.4548 -12.4548 -12.4548 -12.4447 -12.4447 -12.4447 -12.4447
1.9031 1.9031 1.9032 1.9032 2.2204 2.2204 2.2206 2.2206
2.4100 2.4100 2.4103 2.4103 2.5429 2.5429 2.5432 2.5432
2.6563 2.6563 2.6563 2.6563 2.8039 2.8039 2.8039 2.8039
8.2117 8.2117 8.2118 8.2118 8.9743 8.9743 8.9821 8.9821
9.1288 9.1288 9.1380 9.1380 10.5977 10.5977 10.6010 10.6010
10.6525 10.6525 10.6539 10.6539 11.6885 11.6886
k = 0.0213 0.0369 0.3144 ( 4296 PWs) bands (ev):
-32.8738 -32.8738 -32.8738 -32.8738 -13.8820 -13.8820 -13.8820 -13.8820
-12.4548 -12.4548 -12.4548 -12.4548 -12.4443 -12.4443 -12.4443 -12.4443
1.8964 1.8964 1.8965 1.8965 2.2199 2.2199 2.2200 2.2200
2.4092 2.4092 2.4094 2.4094 2.5423 2.5423 2.5424 2.5424
2.6566 2.6566 2.6567 2.6567 2.8009 2.8009 2.8009 2.8009
8.2049 8.2049 8.2049 8.2049 9.0502 9.0502 9.0565 9.0565
9.1414 9.1414 9.1484 9.1484 10.6039 10.6039 10.6059 10.6059
10.6512 10.6512 10.6522 10.6522 11.6134 11.6135
k = 0.0142 0.0246 0.3144 ( 4292 PWs) bands (ev):
-32.8738 -32.8738 -32.8738 -32.8738 -13.8818 -13.8818 -13.8818 -13.8818
-12.4547 -12.4547 -12.4547 -12.4547 -12.4441 -12.4441 -12.4441 -12.4441
1.8916 1.8916 1.8917 1.8917 2.2195 2.2195 2.2196 2.2196
2.4086 2.4086 2.4087 2.4087 2.5418 2.5418 2.5419 2.5419
2.6569 2.6569 2.6569 2.6569 2.7987 2.7987 2.7987 2.7987
8.2000 8.2000 8.2000 8.2000 9.1084 9.1084 9.1128 9.1128
9.1509 9.1509 9.1556 9.1556 10.6076 10.6076 10.6083 10.6083
10.6503 10.6503 10.6507 10.6507 11.5578 11.5578
k = 0.0071 0.0123 0.3144 ( 4288 PWs) bands (ev):
-32.8738 -32.8738 -32.8738 -32.8738 -13.8818 -13.8818 -13.8818 -13.8818
-12.4547 -12.4547 -12.4547 -12.4547 -12.4439 -12.4439 -12.4439 -12.4439
1.8887 1.8887 1.8887 1.8887 2.2193 2.2193 2.2193 2.2193
2.4083 2.4083 2.4083 2.4083 2.5416 2.5416 2.5416 2.5416
2.6571 2.6571 2.6571 2.6571 2.7974 2.7974 2.7974 2.7974
8.1970 8.1970 8.1970 8.1970 9.1450 9.1450 9.1469 9.1469
9.1580 9.1580 9.1599 9.1599 10.6088 10.6088 10.6089 10.6089
10.6500 10.6500 10.6501 10.6501 11.5236 11.5236
k = 0.0000 0.0000 0.3144 ( 4276 PWs) bands (ev):
-32.8738 -32.8738 -32.8738 -32.8738 -13.8817 -13.8817 -13.8817 -13.8817
-12.4547 -12.4547 -12.4547 -12.4547 -12.4438 -12.4438 -12.4438 -12.4438
1.8877 1.8877 1.8877 1.8877 2.2193 2.2193 2.2193 2.2193
2.4082 2.4082 2.4082 2.4082 2.5415 2.5415 2.5415 2.5415
2.6571 2.6571 2.6571 2.6571 2.7970 2.7970 2.7970 2.7970
8.1960 8.1960 8.1960 8.1960 9.1558 9.1558 9.1558 9.1558
9.1631 9.1631 9.1631 9.1631 10.6089 10.6089 10.6089 10.6089
10.6500 10.6500 10.6500 10.6500 11.5120 11.5120
k = 0.5000 0.2887 0.3144 ( 4256 PWs) bands (ev):
-32.8715 -32.8715 -32.8715 -32.8715 -13.8989 -13.8989 -13.8989 -13.8989
-12.4885 -12.4885 -12.4885 -12.4885 -12.4532 -12.4532 -12.4532 -12.4532
2.1789 2.1789 2.1789 2.1789 2.3132 2.3132 2.3132 2.3132
2.5336 2.5336 2.5336 2.5336 2.6475 2.6475 2.6475 2.6475
2.6816 2.6816 2.6816 2.6816 4.1250 4.1250 4.1250 4.1250
4.9261 4.9261 4.9261 4.9261 8.3240 8.3240 8.3240 8.3240
9.2727 9.2727 9.2727 9.2727 9.5319 9.5319 9.5319 9.5319
11.9657 11.9657 11.9657 11.9657 12.4482 12.4482
k = 0.5000 0.2887 0.3007 ( 4264 PWs) bands (ev):
-32.8724 -32.8724 -32.8707 -32.8707 -13.9012 -13.9012 -13.8966 -13.8966
-12.4889 -12.4889 -12.4889 -12.4889 -12.4588 -12.4588 -12.4469 -12.4469
2.1770 2.1770 2.1807 2.1807 2.3121 2.3121 2.3143 2.3143
2.5331 2.5331 2.5341 2.5341 2.6468 2.6468 2.6482 2.6482
2.6811 2.6811 2.6820 2.6820 4.1047 4.1047 4.1458 4.1458
4.8606 4.8606 4.9938 4.9938 8.2945 8.2945 8.3536 8.3536
9.2495 9.2495 9.2874 9.2874 9.4445 9.4445 9.6213 9.6213
11.8853 11.8853 12.0537 12.0537 12.4282 12.4282
k = 0.5000 0.2887 0.2871 ( 4262 PWs) bands (ev):
-32.8732 -32.8732 -32.8699 -32.8699 -13.9036 -13.9036 -13.8943 -13.8943
-12.4903 -12.4903 -12.4897 -12.4897 -12.4632 -12.4632 -12.4400 -12.4400
2.1750 2.1750 2.1825 2.1825 2.3110 2.3110 2.3155 2.3155
2.5326 2.5326 2.5345 2.5345 2.6462 2.6462 2.6490 2.6490
2.6806 2.6806 2.6824 2.6824 4.0849 4.0849 4.1669 4.1669
4.7973 4.7973 5.0635 5.0635 8.2653 8.2653 8.3833 8.3833
9.2195 9.2195 9.2913 9.2913 9.3608 9.3608 9.7121 9.7121
11.8158 11.8158 12.1442 12.1442 12.4083 12.4083
k = 0.5000 0.2887 0.2734 ( 4266 PWs) bands (ev):
-32.8740 -32.8740 -32.8691 -32.8691 -13.9060 -13.9060 -13.8921 -13.8921
-12.4932 -12.4932 -12.4907 -12.4907 -12.4660 -12.4660 -12.4330 -12.4330
2.1730 2.1730 2.1841 2.1841 2.3100 2.3100 2.3166 2.3166
2.5321 2.5321 2.5350 2.5350 2.6456 2.6456 2.6498 2.6498
2.6801 2.6801 2.6827 2.6827 4.0658 4.0658 4.1884 4.1884
4.7363 4.7363 5.1352 5.1352 8.2365 8.2365 8.4129 8.4129
9.1836 9.1836 9.2643 9.2643 9.3002 9.3002 9.8039 9.8039
11.7596 11.7596 12.2290 12.2290 12.3887 12.3887
k = 0.5000 0.2887 0.2597 ( 4276 PWs) bands (ev):
-32.8748 -32.8748 -32.8683 -32.8683 -13.9084 -13.9084 -13.8900 -13.8900
-12.4974 -12.4974 -12.4919 -12.4919 -12.4674 -12.4674 -12.4258 -12.4258
2.1708 2.1708 2.1856 2.1856 2.3090 2.3090 2.3178 2.3178
2.5315 2.5315 2.5354 2.5354 2.6451 2.6451 2.6507 2.6507
2.6796 2.6796 2.6830 2.6830 4.0473 4.0473 4.2100 4.2100
4.6778 4.6778 5.2086 5.2086 8.2083 8.2083 8.4422 8.4422
9.1414 9.1414 9.1929 9.1929 9.2774 9.2774 9.8963 9.8963
11.7182 11.7182 12.2962 12.2962 12.3698 12.3698
k = 0.5000 0.2887 0.2461 ( 4284 PWs) bands (ev):
-32.8756 -32.8756 -32.8675 -32.8675 -13.9108 -13.9108 -13.8879 -13.8879
-12.5024 -12.5024 -12.4931 -12.4931 -12.4677 -12.4677 -12.4185 -12.4185
2.1687 2.1687 2.1871 2.1871 2.3080 2.3080 2.3189 2.3189
2.5310 2.5310 2.5358 2.5358 2.6447 2.6447 2.6517 2.6517
2.6791 2.6791 2.6833 2.6833 4.0296 4.0296 4.2317 4.2317
4.6218 4.6218 5.2838 5.2838 8.1808 8.1808 8.4711 8.4711
9.0873 9.0873 9.1277 9.1277 9.2481 9.2481 9.9891 9.9891
11.6924 11.6924 12.3324 12.3324 12.3553 12.3553
k = 0.5000 0.2887 0.2324 ( 4288 PWs) bands (ev):
-32.8763 -32.8763 -32.8668 -32.8668 -13.9131 -13.9131 -13.8860 -13.8860
-12.5079 -12.5079 -12.4944 -12.4944 -12.4674 -12.4674 -12.4113 -12.4113
2.1666 2.1666 2.1884 2.1884 2.3071 2.3071 2.3201 2.3201
2.5304 2.5304 2.5361 2.5361 2.6443 2.6443 2.6527 2.6527
2.6786 2.6786 2.6835 2.6835 4.0127 4.0127 4.2532 4.2532
4.5685 4.5685 5.3605 5.3605 8.1541 8.1541 8.4995 8.4995
9.0194 9.0194 9.0769 9.0769 9.2075 9.2075 10.0817 10.0817
11.6823 11.6823 12.3264 12.3264 12.3571 12.3571
k = 0.5000 0.2887 0.2187 ( 4288 PWs) bands (ev):
-32.8771 -32.8771 -32.8660 -32.8660 -13.9155 -13.9155 -13.8841 -13.8841
-12.5136 -12.5136 -12.4958 -12.4958 -12.4667 -12.4667 -12.4043 -12.4043
2.1644 2.1644 2.1896 2.1896 2.3063 2.3063 2.3212 2.3212
2.5300 2.5300 2.5364 2.5364 2.6440 2.6440 2.6537 2.6537
2.6780 2.6780 2.6838 2.6838 3.9967 3.9967 4.2744 4.2744
4.5180 4.5180 5.4387 5.4387 8.1284 8.1284 8.5271 8.5271
8.9481 8.9481 9.0316 9.0316 9.1559 9.1559 10.1738 10.1738
11.6872 11.6872 12.3095 12.3095 12.3528 12.3528
k = 0.5000 0.2887 0.2050 ( 4284 PWs) bands (ev):
-32.8778 -32.8778 -32.8653 -32.8653 -13.9178 -13.9178 -13.8823 -13.8823
-12.5192 -12.5192 -12.4971 -12.4971 -12.4658 -12.4658 -12.3973 -12.3973
2.1623 2.1623 2.1907 2.1907 2.3055 2.3055 2.3222 2.3222
2.5295 2.5295 2.5367 2.5367 2.6438 2.6438 2.6548 2.6548
2.6775 2.6775 2.6840 2.6840 3.9815 3.9815 4.2947 4.2947
4.4707 4.4707 5.5180 5.5180 8.1036 8.1036 8.5538 8.5538
8.8782 8.8782 8.9879 8.9879 9.0942 9.0942 10.2649 10.2649
11.7062 11.7062 12.2920 12.2920 12.3400 12.3400
k = 0.5000 0.2887 0.1914 ( 4286 PWs) bands (ev):
-32.8785 -32.8785 -32.8646 -32.8646 -13.9200 -13.9200 -13.8806 -13.8806
-12.5247 -12.5247 -12.4983 -12.4983 -12.4649 -12.4649 -12.3906 -12.3906
2.1602 2.1602 2.1917 2.1917 2.3048 2.3048 2.3233 2.3233
2.5290 2.5290 2.5369 2.5369 2.6436 2.6436 2.6559 2.6559
2.6770 2.6770 2.6841 2.6841 3.9672 3.9672 4.3133 4.3133
4.4276 4.4276 5.5983 5.5983 8.0800 8.0800 8.5795 8.5795
8.8111 8.8111 8.9456 8.9456 9.0238 9.0238 10.3545 10.3545
11.7378 11.7378 12.2750 12.2750 12.3228 12.3228
k = 0.5000 0.2887 0.1777 ( 4282 PWs) bands (ev):
-32.8791 -32.8791 -32.8640 -32.8640 -13.9221 -13.9221 -13.8791 -13.8791
-12.5300 -12.5300 -12.4995 -12.4995 -12.4638 -12.4638 -12.3842 -12.3842
2.1582 2.1582 2.1926 2.1926 2.3041 2.3041 2.3243 2.3243
2.5286 2.5286 2.5371 2.5371 2.6434 2.6434 2.6571 2.6571
2.6764 2.6764 2.6843 2.6843 3.9538 3.9538 4.3264 4.3264
4.3922 4.3922 5.6793 5.6793 8.0577 8.0577 8.6038 8.6038
8.7475 8.7475 8.9048 8.9048 8.9464 8.9464 10.4422 10.4422
11.7803 11.7803 12.2584 12.2584 12.3038 12.3038
k = 0.5000 0.2887 0.1640 ( 4290 PWs) bands (ev):
-32.8797 -32.8797 -32.8633 -32.8633 -13.9242 -13.9242 -13.8776 -13.8776
-12.5350 -12.5350 -12.5007 -12.5007 -12.4628 -12.4628 -12.3780 -12.3780
2.1562 2.1562 2.1934 2.1934 2.3035 2.3035 2.3252 2.3252
2.5282 2.5282 2.5373 2.5373 2.6433 2.6433 2.6582 2.6582
2.6759 2.6759 2.6843 2.6843 3.9414 3.9414 4.3194 4.3194
4.3791 4.3791 5.7607 5.7607 8.0366 8.0366 8.6259 8.6259
8.6883 8.6883 8.8617 8.8617 8.8676 8.8676 10.5274 10.5274
11.8320 11.8320 12.2424 12.2424 12.2846 12.2846
k = 0.5000 0.2887 0.1504 ( 4276 PWs) bands (ev):
-32.8803 -32.8803 -32.8628 -32.8628 -13.9261 -13.9261 -13.8762 -13.8762
-12.5397 -12.5397 -12.5018 -12.5018 -12.4618 -12.4618 -12.3722 -12.3722
2.1543 2.1543 2.1942 2.1942 2.3030 2.3030 2.3261 2.3261
2.5278 2.5278 2.5375 2.5375 2.6433 2.6433 2.6593 2.6593
2.6755 2.6755 2.6844 2.6844 3.9299 3.9299 4.2918 4.2918
4.3887 4.3887 5.8420 5.8420 8.0169 8.0169 8.6238 8.6238
8.6556 8.6556 8.7768 8.7768 8.8293 8.8293 10.6095 10.6095
11.8914 11.8914 12.2271 12.2271 12.2660 12.2660
k = 0.5000 0.2887 0.1367 ( 4272 PWs) bands (ev):
-32.8808 -32.8808 -32.8622 -32.8622 -13.9279 -13.9279 -13.8750 -13.8750
-12.5441 -12.5441 -12.5029 -12.5029 -12.4608 -12.4608 -12.3667 -12.3667
2.1525 2.1525 2.1948 2.1948 2.3025 2.3025 2.3269 2.3269
2.5275 2.5275 2.5376 2.5376 2.6432 2.6432 2.6604 2.6604
2.6750 2.6750 2.6845 2.6845 3.9194 3.9194 4.2606 4.2606
4.4039 4.4039 5.9229 5.9229 7.9987 7.9987 8.5749 8.5749
8.6699 8.6699 8.6905 8.6905 8.7948 8.7948 10.6879 10.6879
11.9566 11.9566 12.2122 12.2122 12.2488 12.2488
k = 0.5000 0.2887 0.1230 ( 4278 PWs) bands (ev):
-32.8813 -32.8813 -32.8617 -32.8617 -13.9296 -13.9296 -13.8738 -13.8738
-12.5481 -12.5481 -12.5038 -12.5038 -12.4599 -12.4599 -12.3617 -12.3617
2.1508 2.1508 2.1953 2.1953 2.3021 2.3021 2.3277 2.3277
2.5272 2.5272 2.5377 2.5377 2.6432 2.6432 2.6615 2.6615
2.6746 2.6746 2.6845 2.6845 3.9099 3.9099 4.2308 4.2308
4.4195 4.4195 6.0026 6.0026 7.9820 7.9820 8.5266 8.5266
8.5987 8.5987 8.6912 8.6912 8.7633 8.7633 10.7618 10.7618
12.0263 12.0263 12.1981 12.1981 12.2332 12.2332
k = 0.5000 0.2887 0.1094 ( 4280 PWs) bands (ev):
-32.8818 -32.8818 -32.8613 -32.8613 -13.9312 -13.9312 -13.8728 -13.8728
-12.5517 -12.5517 -12.5047 -12.5047 -12.4591 -12.4591 -12.3571 -12.3571
2.1493 2.1493 2.1958 2.1958 2.3018 2.3018 2.3284 2.3284
2.5269 2.5269 2.5378 2.5378 2.6432 2.6432 2.6625 2.6625
2.6742 2.6742 2.6845 2.6845 3.9014 3.9014 4.2035 4.2035
4.4345 4.4345 6.0805 6.0805 7.9669 7.9669 8.4797 8.4797
8.5139 8.5139 8.7068 8.7068 8.7354 8.7354 10.8307 10.8307
12.0988 12.0988 12.1847 12.1847 12.2195 12.2195
k = 0.5000 0.2887 0.0957 ( 4280 PWs) bands (ev):
-32.8822 -32.8822 -32.8609 -32.8609 -13.9326 -13.9326 -13.8719 -13.8719
-12.5550 -12.5550 -12.5055 -12.5055 -12.4584 -12.4584 -12.3529 -12.3529
2.1479 2.1479 2.1961 2.1961 2.3014 2.3014 2.3290 2.3290
2.5267 2.5267 2.5379 2.5379 2.6432 2.6432 2.6634 2.6634
2.6738 2.6738 2.6844 2.6844 3.8939 3.8939 4.1791 4.1791
4.4484 4.4484 6.1554 6.1554 7.9535 7.9535 8.4169 8.4169
8.4522 8.4522 8.7049 8.7049 8.7267 8.7267 10.8937 10.8937
12.1706 12.1706 12.1744 12.1744 12.2076 12.2076
k = 0.5000 0.2887 0.0820 ( 4280 PWs) bands (ev):
-32.8825 -32.8825 -32.8605 -32.8605 -13.9338 -13.9338 -13.8711 -13.8711
-12.5578 -12.5578 -12.5062 -12.5062 -12.4577 -12.4577 -12.3493 -12.3493
2.1466 2.1466 2.1965 2.1965 2.3012 2.3012 2.3295 2.3295
2.5264 2.5264 2.5379 2.5379 2.6432 2.6432 2.6642 2.6642
2.6735 2.6735 2.6844 2.6844 3.8874 3.8874 4.1577 4.1577
4.4608 4.4608 6.2263 6.2263 7.9418 7.9418 8.3391 8.3391
8.4148 8.4148 8.6839 8.6839 8.7385 8.7385 10.9503 10.9503
12.1608 12.1608 12.1976 12.1976 12.2467 12.2467
k = 0.5000 0.2887 0.0683 ( 4282 PWs) bands (ev):
-32.8828 -32.8828 -32.8602 -32.8602 -13.9349 -13.9349 -13.8704 -13.8704
-12.5602 -12.5602 -12.5068 -12.5068 -12.4571 -12.4571 -12.3462 -12.3462
2.1455 2.1455 2.1967 2.1967 2.3010 2.3010 2.3300 2.3300
2.5263 2.5263 2.5379 2.5379 2.6433 2.6433 2.6649 2.6649
2.6733 2.6733 2.6844 2.6844 3.8819 3.8819 4.1394 4.1394
4.4716 4.4716 6.2916 6.2916 7.9318 7.9318 8.2652 8.2652
8.3849 8.3849 8.6647 8.6647 8.7497 8.7497 10.9996 10.9996
12.1510 12.1510 12.1892 12.1892 12.3186 12.3186
k = 0.5000 0.2887 0.0547 ( 4282 PWs) bands (ev):
-32.8831 -32.8831 -32.8600 -32.8600 -13.9358 -13.9358 -13.8699 -13.8699
-12.5622 -12.5622 -12.5072 -12.5072 -12.4567 -12.4567 -12.3436 -12.3436
2.1446 2.1446 2.1969 2.1969 2.3008 2.3008 2.3303 2.3303
2.5261 2.5261 2.5379 2.5379 2.6433 2.6433 2.6655 2.6655
2.6731 2.6731 2.6843 2.6843 3.8773 3.8773 4.1244 4.1244
4.4806 4.4806 6.3495 6.3495 7.9235 7.9235 8.1995 8.1995
8.3605 8.3605 8.6488 8.6488 8.7591 8.7591 11.0409 11.0409
12.1427 12.1427 12.1825 12.1825 12.3866 12.3866
k = 0.5000 0.2887 0.0410 ( 4274 PWs) bands (ev):
-32.8833 -32.8833 -32.8598 -32.8598 -13.9365 -13.9365 -13.8695 -13.8695
-12.5637 -12.5637 -12.5076 -12.5076 -12.4563 -12.4563 -12.3416 -12.3416
2.1440 2.1440 2.1971 2.1971 2.3007 2.3007 2.3306 2.3306
2.5261 2.5261 2.5380 2.5380 2.6433 2.6433 2.6660 2.6660
2.6729 2.6729 2.6843 2.6843 3.8738 3.8738 4.1127 4.1127
4.4877 4.4877 6.3979 6.3979 7.9171 7.9171 8.1447 8.1447
8.3415 8.3415 8.6363 8.6363 8.7666 8.7666 11.0738 11.0738
12.1361 12.1361 12.1774 12.1774 12.4477 12.4477
k = 0.5000 0.2887 0.0273 ( 4272 PWs) bands (ev):
-32.8834 -32.8834 -32.8596 -32.8596 -13.9369 -13.9369 -13.8692 -13.8692
-12.5648 -12.5648 -12.5079 -12.5079 -12.4560 -12.4560 -12.3401 -12.3401
2.1435 2.1435 2.1972 2.1972 2.3006 2.3006 2.3308 2.3308
2.5260 2.5260 2.5380 2.5380 2.6434 2.6434 2.6664 2.6664
2.6728 2.6728 2.6842 2.6842 3.8713 3.8713 4.1043 4.1043
4.4929 4.4929 6.4346 6.4346 7.9125 7.9125 8.1032 8.1032
8.3279 8.3279 8.6273 8.6273 8.7719 8.7719 11.0977 11.0977
12.1314 12.1314 12.1737 12.1737 12.4980 12.4980
k = 0.5000 0.2887 0.0137 ( 4268 PWs) bands (ev):
-32.8835 -32.8835 -32.8595 -32.8595 -13.9372 -13.9372 -13.8690 -13.8690
-12.5655 -12.5655 -12.5081 -12.5081 -12.4558 -12.4558 -12.3392 -12.3392
2.1432 2.1432 2.1972 2.1972 2.3006 2.3006 2.3309 2.3309
2.5260 2.5260 2.5380 2.5380 2.6434 2.6434 2.6666 2.6666
2.6728 2.6728 2.6842 2.6842 3.8698 3.8698 4.0993 4.0993
4.4960 4.4960 6.4577 6.4577 7.9097 7.9097 8.0772 8.0772
8.3197 8.3197 8.6219 8.6219 8.7752 8.7752 11.1122 11.1122
12.1285 12.1285 12.1715 12.1715 12.5323 12.5323
k = 0.5000 0.2887-0.0000 ( 4278 PWs) bands (ev):
-32.8835 -32.8835 -32.8595 -32.8595 -13.9373 -13.9373 -13.8689 -13.8689
-12.5657 -12.5657 -12.5081 -12.5081 -12.4558 -12.4558 -12.3390 -12.3390
2.1431 2.1431 2.1972 2.1972 2.3005 2.3005 2.3309 2.3309
2.5259 2.5259 2.5380 2.5380 2.6434 2.6434 2.6666 2.6666
2.6728 2.6728 2.6842 2.6842 3.8693 3.8693 4.0976 4.0976
4.4971 4.4971 6.4655 6.4655 7.9087 7.9087 8.0684 8.0684
8.3170 8.3170 8.6201 8.6201 8.7762 8.7762 11.1170 11.1170
12.1275 12.1275 12.1708 12.1708 12.5446 12.5446
k = 0.3333 0.5774-0.0000 ( 4329 PWs) bands (ev):
-32.8832 -32.8832 -32.8593 -32.8593 -13.9388 -13.9388 -13.8715 -13.8715
-12.5646 -12.5646 -12.5125 -12.5125 -12.4618 -12.4618 -12.3412 -12.3412
2.1492 2.1492 2.2706 2.2706 2.3057 2.3057 2.3160 2.3160
2.4493 2.4493 2.6108 2.6108 2.6419 2.6419 2.6539 2.6539
2.6722 2.6722 2.6761 2.6761 4.3997 4.3997 4.4644 4.4644
5.1706 5.1706 5.1707 5.1707 6.0283 6.0283 8.3435 8.3435
8.4216 8.4216 8.4371 8.4371 11.0192 11.0192 11.6950 11.6950
11.7000 11.7000 11.7413 11.7413 11.7671 11.7671
k = 0.3333 0.5774 0.0137 ( 4323 PWs) bands (ev):
-32.8832 -32.8832 -32.8593 -32.8593 -13.9386 -13.9386 -13.8715 -13.8715
-12.5644 -12.5644 -12.5124 -12.5124 -12.4619 -12.4619 -12.3415 -12.3415
2.1493 2.1493 2.2706 2.2706 2.3057 2.3057 2.3161 2.3161
2.4493 2.4493 2.6109 2.6109 2.6419 2.6419 2.6539 2.6539
2.6722 2.6722 2.6762 2.6762 4.4003 4.4003 4.4649 4.4649
5.1692 5.1692 5.1694 5.1694 6.0303 6.0303 8.3412 8.3412
8.4224 8.4224 8.4398 8.4398 11.0209 11.0209 11.6389 11.6389
11.6480 11.6480 11.7446 11.7446 11.8213 11.8213
k = 0.3333 0.5774 0.0273 ( 4311 PWs) bands (ev):
-32.8831 -32.8831 -32.8594 -32.8594 -13.9383 -13.9383 -13.8717 -13.8717
-12.5637 -12.5637 -12.5123 -12.5123 -12.4621 -12.4621 -12.3423 -12.3423
2.1494 2.1494 2.2706 2.2706 2.3059 2.3059 2.3161 2.3161
2.4494 2.4494 2.6109 2.6109 2.6418 2.6418 2.6538 2.6538
2.6723 2.6723 2.6763 2.6763 4.4022 4.4022 4.4666 4.4666
5.1651 5.1651 5.1656 5.1656 6.0365 6.0365 8.3330 8.3330
8.4260 8.4260 8.4477 8.4477 11.0262 11.0262 11.5562 11.5562
11.5668 11.5668 11.7543 11.7543 11.8987 11.8987
k = 0.3333 0.5774 0.0410 ( 4311 PWs) bands (ev):
-32.8830 -32.8830 -32.8595 -32.8595 -13.9379 -13.9379 -13.8720 -13.8720
-12.5625 -12.5625 -12.5120 -12.5120 -12.4624 -12.4624 -12.3438 -12.3438
2.1497 2.1497 2.2707 2.2707 2.3061 2.3061 2.3162 2.3162
2.4495 2.4495 2.6109 2.6109 2.6416 2.6416 2.6536 2.6536
2.6722 2.6722 2.6765 2.6765 4.4052 4.4052 4.4694 4.4694
5.1582 5.1582 5.1594 5.1594 6.0467 6.0467 8.3165 8.3165
8.4350 8.4350 8.4610 8.4610 11.0350 11.0350 11.4694 11.4694
11.4807 11.4807 11.7701 11.7701 11.9765 11.9765
k = 0.3333 0.5774 0.0547 ( 4317 PWs) bands (ev):
-32.8828 -32.8828 -32.8597 -32.8597 -13.9372 -13.9372 -13.8724 -13.8724
-12.5610 -12.5610 -12.5116 -12.5116 -12.4628 -12.4628 -12.3458 -12.3458
2.1500 2.1500 2.2707 2.2707 2.3064 2.3064 2.3163 2.3163
2.4497 2.4497 2.6109 2.6109 2.6414 2.6414 2.6534 2.6534
2.6722 2.6722 2.6768 2.6768 4.4094 4.4094 4.4732 4.4732
5.1487 5.1487 5.1508 5.1508 6.0610 6.0610 8.2907 8.2907
8.4507 8.4507 8.4795 8.4795 11.0471 11.0471 11.3806 11.3806
11.3925 11.3925 11.7912 11.7912 12.0529 12.0529
k = 0.3333 0.5774 0.0683 ( 4329 PWs) bands (ev):
-32.8825 -32.8825 -32.8600 -32.8600 -13.9363 -13.9363 -13.8730 -13.8730
-12.5590 -12.5590 -12.5111 -12.5111 -12.4633 -12.4633 -12.3484 -12.3484
2.1503 2.1503 2.2708 2.2708 2.3068 2.3068 2.3164 2.3164
2.4499 2.4499 2.6109 2.6109 2.6411 2.6411 2.6530 2.6530
2.6722 2.6722 2.6772 2.6772 4.4148 4.4148 4.4782 4.4782
5.1367 5.1367 5.1399 5.1399 6.0793 6.0793 8.2561 8.2561
8.4729 8.4729 8.5030 8.5030 11.0623 11.0623 11.2901 11.2901
11.3030 11.3030 11.8169 11.8169 12.1276 12.1276
k = 0.3333 0.5774 0.0820 ( 4323 PWs) bands (ev):
-32.8822 -32.8822 -32.8603 -32.8603 -13.9353 -13.9353 -13.8736 -13.8736
-12.5565 -12.5565 -12.5104 -12.5104 -12.4640 -12.4640 -12.3516 -12.3516
2.1508 2.1508 2.2709 2.2709 2.3072 2.3072 2.3165 2.3165
2.4501 2.4501 2.6110 2.6110 2.6408 2.6408 2.6526 2.6526
2.6722 2.6722 2.6776 2.6776 4.4215 4.4215 4.4843 4.4843
5.1224 5.1224 5.1269 5.1269 6.1016 6.1016 8.2139 8.2139
8.5011 8.5011 8.5314 8.5314 11.0794 11.0794 11.1984 11.1984
11.2137 11.2137 11.8460 11.8460 12.2005 12.2005
k = 0.3333 0.5774 0.0957 ( 4314 PWs) bands (ev):
-32.8819 -32.8819 -32.8606 -32.8606 -13.9341 -13.9341 -13.8744 -13.8744
-12.5536 -12.5536 -12.5097 -12.5097 -12.4647 -12.4647 -12.3552 -12.3552
2.1514 2.1514 2.2710 2.2710 2.3077 2.3077 2.3167 2.3167
2.4504 2.4504 2.6111 2.6111 2.6405 2.6405 2.6521 2.6521
2.6721 2.6721 2.6781 2.6781 4.4293 4.4293 4.4914 4.4914
5.1059 5.1059 5.1119 5.1119 6.1279 6.1279 8.1649 8.1649
8.5348 8.5348 8.5647 8.5647 11.0846 11.0846 11.1056 11.1056
11.1386 11.1386 11.8775 11.8775 12.2716 12.2716
k = 0.3333 0.5774 0.1094 ( 4314 PWs) bands (ev):
-32.8815 -32.8815 -32.8610 -32.8610 -13.9327 -13.9327 -13.8753 -13.8753
-12.5503 -12.5503 -12.5088 -12.5088 -12.4656 -12.4656 -12.3594 -12.3594
2.1520 2.1520 2.2711 2.2711 2.3083 2.3083 2.3169 2.3169
2.4508 2.4508 2.6112 2.6112 2.6402 2.6402 2.6515 2.6515
2.6721 2.6721 2.6787 2.6787 4.4383 4.4383 4.4997 4.4997
5.0874 5.0874 5.0951 5.0951 6.1580 6.1580 8.1100 8.1100
8.5735 8.5735 8.6025 8.6025 11.0118 11.0118 11.0152 11.0152
11.1404 11.1404 11.9099 11.9099 12.3408 12.3408
k = 0.3333 0.5774 0.1230 ( 4302 PWs) bands (ev):
-32.8810 -32.8810 -32.8615 -32.8615 -13.9311 -13.9311 -13.8763 -13.8763
-12.5466 -12.5466 -12.5079 -12.5079 -12.4665 -12.4665 -12.3640 -12.3640
2.1526 2.1526 2.2713 2.2713 2.3089 2.3089 2.3171 2.3171
2.4511 2.4511 2.6113 2.6113 2.6399 2.6399 2.6509 2.6509
2.6721 2.6721 2.6793 2.6793 4.4486 4.4486 4.5091 4.5091
5.0672 5.0672 5.0766 5.0766 6.1918 6.1918 8.0499 8.0499
8.6170 8.6170 8.6448 8.6448 10.9174 10.9174 10.9235 10.9235
11.1670 11.1670 11.9419 11.9419 12.4083 12.4083
k = 0.3333 0.5774 0.1367 ( 4296 PWs) bands (ev):
-32.8805 -32.8805 -32.8620 -32.8620 -13.9295 -13.9295 -13.8774 -13.8774
-12.5424 -12.5424 -12.5068 -12.5068 -12.4676 -12.4676 -12.3691 -12.3691
2.1533 2.1533 2.2714 2.2714 2.3095 2.3095 2.3174 2.3174
2.4515 2.4515 2.6114 2.6114 2.6396 2.6396 2.6502 2.6502
2.6720 2.6720 2.6800 2.6800 4.4600 4.4600 4.5195 4.5195
5.0454 5.0454 5.0568 5.0568 6.2294 6.2294 7.9856 7.9856
8.6650 8.6650 8.6913 8.6913 10.8225 10.8225 10.8293 10.8293
11.1988 11.1988 11.9720 11.9720 12.4742 12.4742
k = 0.3333 0.5774 0.1504 ( 4287 PWs) bands (ev):
-32.8800 -32.8800 -32.8625 -32.8625 -13.9277 -13.9277 -13.8786 -13.8786
-12.5379 -12.5379 -12.5057 -12.5057 -12.4687 -12.4687 -12.3746 -12.3746
2.1540 2.1540 2.2716 2.2716 2.3102 2.3102 2.3176 2.3176
2.4519 2.4519 2.6115 2.6115 2.6393 2.6393 2.6495 2.6495
2.6720 2.6720 2.6807 2.6807 4.4726 4.4726 4.5311 4.5311
5.0222 5.0222 5.0356 5.0356 6.2705 6.2705 7.9175 7.9175
8.7171 8.7171 8.7417 8.7417 10.7272 10.7272 10.7341 10.7341
11.2341 11.2341 11.9988 11.9988 12.5383 12.5383
k = 0.3333 0.5774 0.1640 ( 4272 PWs) bands (ev):
-32.8794 -32.8794 -32.8631 -32.8631 -13.9257 -13.9257 -13.8799 -13.8799
-12.5330 -12.5330 -12.5045 -12.5045 -12.4699 -12.4699 -12.3805 -12.3805
2.1547 2.1547 2.2717 2.2717 2.3109 2.3109 2.3178 2.3178
2.4523 2.4523 2.6116 2.6116 2.6391 2.6391 2.6487 2.6487
2.6720 2.6720 2.6814 2.6814 4.4863 4.4863 4.5437 4.5437
4.9979 4.9979 5.0134 5.0134 6.3152 6.3152 7.8464 7.8464
8.7732 8.7732 8.7960 8.7960 10.6319 10.6319 10.6386 10.6386
11.2726 11.2726 12.0210 12.0210 12.6010 12.6010
k = 0.3333 0.5774 0.1777 ( 4281 PWs) bands (ev):
-32.8788 -32.8788 -32.8637 -32.8637 -13.9237 -13.9237 -13.8814 -13.8814
-12.5278 -12.5278 -12.5032 -12.5032 -12.4712 -12.4712 -12.3867 -12.3867
2.1554 2.1554 2.2719 2.2719 2.3115 2.3115 2.3181 2.3181
2.4527 2.4527 2.6117 2.6117 2.6389 2.6389 2.6478 2.6478
2.6719 2.6719 2.6820 2.6820 4.5012 4.5012 4.5573 4.5573
4.9726 4.9726 4.9904 4.9904 6.3633 6.3633 7.7728 7.7728
8.8329 8.8329 8.8538 8.8538 10.5367 10.5367 10.5429 10.5429
11.3139 11.3139 12.0372 12.0372 12.6621 12.6622
k = 0.3333 0.5774 0.1914 ( 4281 PWs) bands (ev):
-32.8781 -32.8781 -32.8644 -32.8644 -13.9216 -13.9216 -13.8829 -13.8829
-12.5222 -12.5222 -12.5018 -12.5018 -12.4726 -12.4726 -12.3933 -12.3933
2.1561 2.1561 2.2720 2.2720 2.3121 2.3121 2.3183 2.3183
2.4531 2.4531 2.6118 2.6118 2.6387 2.6387 2.6470 2.6470
2.6719 2.6719 2.6826 2.6826 4.5173 4.5173 4.5720 4.5720
4.9467 4.9467 4.9666 4.9666 6.4146 6.4146 7.6973 7.6973
8.8959 8.8959 8.9149 8.9149 10.4417 10.4417 10.4474 10.4474
11.3578 11.3578 12.0466 12.0466 12.7218 12.7218
k = 0.3333 0.5774 0.2050 ( 4281 PWs) bands (ev):
-32.8775 -32.8775 -32.8650 -32.8650 -13.9194 -13.9194 -13.8846 -13.8846
-12.5162 -12.5162 -12.5004 -12.5004 -12.4741 -12.4741 -12.4001 -12.4001
2.1567 2.1567 2.2721 2.2721 2.3127 2.3127 2.3185 2.3185
2.4534 2.4534 2.6119 2.6119 2.6386 2.6386 2.6461 2.6461
2.6718 2.6718 2.6832 2.6832 4.5344 4.5344 4.5877 4.5877
4.9201 4.9201 4.9424 4.9424 6.4690 6.4690 7.6204 7.6204
8.9621 8.9621 8.9791 8.9791 10.3474 10.3474 10.3523 10.3523
11.4040 11.4040 12.0485 12.0485 12.7802 12.7802
k = 0.3333 0.5774 0.2187 ( 4272 PWs) bands (ev):
-32.8767 -32.8767 -32.8658 -32.8658 -13.9172 -13.9172 -13.8863 -13.8863
-12.5100 -12.5100 -12.4989 -12.4989 -12.4756 -12.4756 -12.4072 -12.4072
2.1573 2.1573 2.2722 2.2722 2.3132 2.3132 2.3187 2.3187
2.4538 2.4538 2.6120 2.6120 2.6386 2.6386 2.6453 2.6453
2.6718 2.6718 2.6838 2.6838 4.5527 4.5527 4.6045 4.6045
4.8933 4.8933 4.9177 4.9177 6.5265 6.5265 7.5424 7.5424
9.0312 9.0312 9.0462 9.0462 10.2538 10.2538 10.2578 10.2578
11.4523 11.4523 12.0424 12.0424 12.8372 12.8372
k = 0.3333 0.5774 0.2324 ( 4275 PWs) bands (ev):
-32.8760 -32.8760 -32.8665 -32.8665 -13.9149 -13.9149 -13.8882 -13.8882
-12.5035 -12.5035 -12.4973 -12.4973 -12.4771 -12.4771 -12.4144 -12.4144
2.1578 2.1578 2.2723 2.2723 2.3137 2.3137 2.3189 2.3189
2.4541 2.4541 2.6121 2.6121 2.6386 2.6386 2.6444 2.6444
2.6718 2.6718 2.6843 2.6843 4.5720 4.5720 4.6221 4.6221
4.8662 4.8662 4.8930 4.8930 6.5867 6.5867 7.4638 7.4638
9.1027 9.1027 9.1157 9.1157 10.1612 10.1612 10.1643 10.1643
11.5022 11.5022 12.0285 12.0285 12.8929 12.8929
k = 0.3333 0.5774 0.2461 ( 4269 PWs) bands (ev):
-32.8753 -32.8753 -32.8673 -32.8673 -13.9126 -13.9126 -13.8901 -13.8901
-12.4967 -12.4967 -12.4957 -12.4957 -12.4788 -12.4788 -12.4219 -12.4219
2.1583 2.1583 2.2725 2.2725 2.3142 2.3142 2.3190 2.3190
2.4544 2.4544 2.6122 2.6122 2.6386 2.6386 2.6437 2.6437
2.6718 2.6718 2.6847 2.6847 4.5923 4.5923 4.6408 4.6408
4.8391 4.8391 4.8681 4.8681 6.6497 6.6497 7.3850 7.3850
9.1763 9.1763 9.1873 9.1873 10.0702 10.0702 10.0722 10.0722
11.5535 11.5535 12.0070 12.0070 12.9472 12.9472
k = 0.3333 0.5774 0.2597 ( 4287 PWs) bands (ev):
-32.8745 -32.8745 -32.8680 -32.8680 -13.9102 -13.9102 -13.8921 -13.8921
-12.4941 -12.4941 -12.4898 -12.4898 -12.4804 -12.4804 -12.4295 -12.4295
2.1587 2.1587 2.2725 2.2725 2.3145 2.3145 2.3191 2.3191
2.4546 2.4546 2.6122 2.6122 2.6387 2.6387 2.6429 2.6429
2.6717 2.6717 2.6850 2.6850 4.6136 4.6136 4.6602 4.6602
4.8121 4.8121 4.8434 4.8434 6.7152 6.7152 7.3064 7.3064
9.2514 9.2514 9.2603 9.2603 9.9813 9.9813 9.9819 9.9819
11.6058 11.6058 11.9785 11.9785 13.0002 13.0002
k = 0.3333 0.5774 0.2734 ( 4287 PWs) bands (ev):
-32.8737 -32.8737 -32.8688 -32.8688 -13.9079 -13.9079 -13.8942 -13.8942
-12.4924 -12.4924 -12.4826 -12.4826 -12.4821 -12.4821 -12.4371 -12.4371
2.1590 2.1590 2.2726 2.2726 2.3148 2.3148 2.3192 2.3192
2.4548 2.4548 2.6123 2.6123 2.6389 2.6389 2.6422 2.6422
2.6717 2.6717 2.6853 2.6853 4.6359 4.6359 4.6805 4.6805
4.7853 4.7853 4.8190 4.8190 6.7829 6.7829 7.2282 7.2282
9.3269 9.3269 9.3337 9.3337 9.8947 9.8947 9.8956 9.8956
11.6584 11.6584 11.9439 11.9439 13.0518 13.0518
k = 0.3333 0.5774 0.2871 ( 4290 PWs) bands (ev):
-32.8729 -32.8729 -32.8696 -32.8696 -13.9055 -13.9055 -13.8964 -13.8964
-12.4907 -12.4907 -12.4838 -12.4838 -12.4752 -12.4752 -12.4448 -12.4448
2.1593 2.1593 2.2726 2.2726 2.3150 2.3150 2.3193 2.3193
2.4550 2.4550 2.6123 2.6123 2.6391 2.6391 2.6416 2.6416
2.6716 2.6716 2.6855 2.6855 4.6590 4.6590 4.7014 4.7014
4.7589 4.7589 4.7951 4.7951 6.8528 6.8528 7.1508 7.1508
9.4001 9.4001 9.4047 9.4047 9.8130 9.8130 9.8157 9.8157
11.7108 11.7108 11.9040 11.9040 13.1016 13.1016
k = 0.3333 0.5774 0.3007 ( 4296 PWs) bands (ev):
-32.8721 -32.8721 -32.8705 -32.8705 -13.9032 -13.9032 -13.8986 -13.8986
-12.4890 -12.4890 -12.4855 -12.4855 -12.4677 -12.4677 -12.4525 -12.4525
2.1594 2.1594 2.2726 2.2726 2.3151 2.3151 2.3193 2.3193
2.4551 2.4551 2.6123 2.6123 2.6393 2.6393 2.6412 2.6412
2.6716 2.6716 2.6857 2.6857 4.6829 4.6829 4.7226 4.7226
4.7330 4.7330 4.7722 4.7722 6.9244 6.9244 7.0747 7.0747
9.4637 9.4637 9.4658 9.4658 9.7445 9.7445 9.7493 9.7493
11.7623 11.7623 11.8599 11.8599 13.1486 13.1486
k = 0.3333 0.5774 0.3144 ( 4290 PWs) bands (ev):
-32.8713 -32.8713 -32.8713 -32.8713 -13.9011 -13.9011 -13.9007 -13.9007
-12.4877 -12.4877 -12.4869 -12.4869 -12.4603 -12.4603 -12.4600 -12.4600
2.1594 2.1594 2.2726 2.2726 2.3152 2.3152 2.3194 2.3194
2.4551 2.4551 2.6124 2.6124 2.6394 2.6394 2.6410 2.6410
2.6716 2.6716 2.6857 2.6857 4.7068 4.7068 4.7085 4.7085
4.7377 4.7377 4.7564 4.7564 6.9885 6.9885 7.0091 7.0091
9.4934 9.4934 9.4940 9.4940 9.7130 9.7130 9.7194 9.7194
11.8107 11.8107 11.8139 11.8139 13.1793 13.1793
Writing output data file YAlZn.save
init_run : 0.34s CPU 0.48s WALL ( 1 calls)
electrons : 229.29s CPU 232.49s WALL ( 1 calls)
Called by init_run:
wfcinit : 0.00s CPU 0.03s WALL ( 1 calls)
potinit : 0.02s CPU 0.03s WALL ( 1 calls)
Called by electrons:
c_bands : 229.29s CPU 232.48s WALL ( 1 calls)
v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls)
v_h : 0.00s CPU 0.00s WALL ( 1 calls)
v_xc : 0.00s CPU 0.00s WALL ( 1 calls)
newd : 0.10s CPU 0.13s WALL ( 1 calls)
Called by c_bands:
init_us_2 : 0.05s CPU 0.07s WALL ( 302 calls)
cegterg : 207.43s CPU 209.97s WALL ( 614 calls)
Called by sum_band:
Called by *egterg:
h_psi : 102.15s CPU 103.60s WALL ( 10028 calls)
s_psi : 10.26s CPU 10.37s WALL ( 10028 calls)
g_psi : 0.29s CPU 0.29s WALL ( 9112 calls)
cdiaghg : 87.47s CPU 88.50s WALL ( 9414 calls)
cegterg:over : 8.64s CPU 8.57s WALL ( 9112 calls)
cegterg:upda : 7.76s CPU 7.93s WALL ( 9112 calls)
cegterg:last : 3.29s CPU 3.28s WALL ( 1218 calls)
cdiaghg:chol : 4.97s CPU 5.01s WALL ( 9414 calls)
cdiaghg:inve : 3.68s CPU 3.61s WALL ( 9414 calls)
cdiaghg:para : 5.60s CPU 5.74s WALL ( 18828 calls)
Called by h_psi:
h_psi:vloc : 79.92s CPU 81.38s WALL ( 10028 calls)
h_psi:vnl : 21.92s CPU 21.90s WALL ( 10028 calls)
add_vuspsi : 12.22s CPU 12.20s WALL ( 10028 calls)
General routines
calbec : 9.65s CPU 9.68s WALL ( 10028 calls)
fft : 0.00s CPU 0.01s WALL ( 19 calls)
ffts : 0.00s CPU 0.00s WALL ( 4 calls)
fftw : 75.00s CPU 76.52s WALL ( 996904 calls)
interpolate : 0.00s CPU 0.00s WALL ( 4 calls)
davcio : 0.16s CPU 0.24s WALL ( 604 calls)
Parallel routines
fft_scatter : 27.25s CPU 28.07s WALL ( 996927 calls)
PWSCF : 4m 7.69s CPU 4m22.42s WALL
This run was terminated on: 19:46:13 24Dec2016
=------------------------------------------------------------------------------=
JOB DONE.
=------------------------------------------------------------------------------=