Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 19:33: 6
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:
./LiIn.save/
file In.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 4D 4D 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 65 65 18 2077 2077 304
Max 66 66 19 2079 2079 308
Sum 2347 2347 649 74825 74825 10969
bravais-lattice index = 14
lattice parameter (alat) = 9.0757 a.u.
unit-cell volume = 528.6029 (a.u.)^3
number of atoms/cell = 4
number of atomic types = 2
number of electrons = 32.00
number of Kohn-Sham states= 40
kinetic-energy cutoff = 103.0000 Ry
charge density cutoff = 412.0000 Ry
Exchange-correlation = PBE ( 1 4 3 4 0 0)
Non magnetic calculation with spin-orbit
celldm(1)= 9.075729 celldm(2)= 1.000000 celldm(3)= 1.000000
celldm(4)= 0.500000 celldm(5)= 0.500000 celldm(6)= 0.500000
crystal axes: (cart. coord. in units of alat)
a(1) = ( 1.000000 0.000000 0.000000 )
a(2) = ( 0.500000 0.866025 0.000000 )
a(3) = ( 0.500000 0.288675 0.816497 )
reciprocal axes: (cart. coord. in units 2 pi/alat)
b(1) = ( 1.000000 -0.577350 -0.408248 )
b(2) = ( 0.000000 1.154701 -0.408248 )
b(3) = ( 0.000000 0.000000 1.224745 )
PseudoPot. # 1 for In read from file:
/users/gautes/Pseudo/In.rel-pbe-dn-rrkjus_psl.1.0.0.UPF
MD5 check sum: 52ff8a85f9af3f41268f91f861ab85bf
Pseudo is Ultrasoft + core correction, Zval = 13.0
Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656
Using radial grid of 1241 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 Li read from file:
/users/gautes/Pseudo/Li.rel-pbe-s-rrkjus_psl.1.0.0.UPF
MD5 check sum: 9da6379fed0e9079eb53e17c51ce5ca0
Pseudo is Ultrasoft, Zval = 3.0
Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656
Using radial grid of 1017 points, 6 beta functions with:
l(1) = 0
l(2) = 0
l(3) = 1
l(4) = 1
l(5) = 1
l(6) = 1
Q(r) pseudized with 0 coefficients
atomic species valence mass pseudopotential
In 13.00 114.81800 In( 1.00)
Li 3.00 6.94100 Li( 1.00)
12 Sym. Ops., with inversion, found (10 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 [1,0,0]
cryst. s( 2) = ( 1 0 0 ) f =( 0.0000000 )
( 1 -1 0 ) ( 0.5000000 )
( 1 0 -1 ) ( 0.5000000 )
cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 )
( 0.0000000 -1.0000000 -0.0000000 ) ( 0.5773503 )
( 0.0000000 0.0000000 -1.0000000 ) ( 0.4082483 )
isym = 3 120 deg rotation - cryst. axis [0,0,1]
cryst. s( 3) = ( -1 1 0 ) f =( -0.5000000 )
( -1 0 0 ) ( 0.0000000 )
( -1 0 1 ) ( 0.0000000 )
cart. s( 3) = ( -0.5000000 -0.8660254 0.0000000 ) f =( -0.5000000 )
( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 )
( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 )
isym = 4 120 deg rotation - cryst. axis [0,0,-1]
cryst. s( 4) = ( 0 -1 0 ) f =( 0.0000000 )
( 1 -1 0 ) ( -0.5000000 )
( 0 -1 1 ) ( 0.0000000 )
cart. s( 4) = ( -0.5000000 0.8660254 0.0000000 ) f =( -0.2500000 )
( -0.8660254 -0.5000000 0.0000000 ) ( -0.4330127 )
( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 )
isym = 5 180 deg rotation - cryst. axis [0,1,0]
cryst. s( 5) = ( 0 -1 0 ) f =( -0.5000000 )
( -1 0 0 ) ( -0.5000000 )
( 0 0 -1 ) ( 0.5000000 )
cart. s( 5) = ( -0.5000000 -0.8660254 0.0000000 ) f =( -0.5000000 )
( -0.8660254 0.5000000 -0.0000000 ) ( -0.2886751 )
( 0.0000000 0.0000000 -1.0000000 ) ( 0.4082483 )
isym = 6 180 deg rotation - cryst. axis [1,1,0]
cryst. s( 6) = ( -1 1 0 ) f =( -0.5000000 )
( 0 1 0 ) ( 0.0000000 )
( 0 1 -1 ) ( 0.5000000 )
cart. s( 6) = ( -0.5000000 0.8660254 -0.0000000 ) f =( -0.2500000 )
( 0.8660254 0.5000000 -0.0000000 ) ( 0.1443376 )
( 0.0000000 0.0000000 -1.0000000 ) ( 0.4082483 )
isym = 7 inversion
cryst. s( 7) = ( -1 0 0 ) f =( -0.5000000 )
( 0 -1 0 ) ( 0.5000000 )
( 0 0 -1 ) ( 0.5000000 )
cart. s( 7) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.0000000 )
( 0.0000000 -1.0000000 -0.0000000 ) ( 0.5773503 )
( 0.0000000 0.0000000 -1.0000000 ) ( 0.4082483 )
isym = 8 inv. 180 deg rotation - cart. axis [1,0,0]
cryst. s( 8) = ( -1 0 0 ) f =( -0.5000000 )
( -1 1 0 ) ( 0.0000000 )
( -1 0 1 ) ( 0.0000000 )
cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.5000000 )
( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 )
( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 )
isym = 9 inv. 120 deg rotation - cryst. axis [0,0,1]
cryst. s( 9) = ( 1 -1 0 ) f =( 0.0000000 )
( 1 0 0 ) ( -0.5000000 )
( 1 0 -1 ) ( 0.5000000 )
cart. s( 9) = ( 0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 )
( -0.8660254 0.5000000 -0.0000000 ) ( -0.2886751 )
( 0.0000000 0.0000000 -1.0000000 ) ( 0.4082483 )
isym = 10 inv. 120 deg rotation - cryst. axis [0,0,-1]
cryst. s(10) = ( 0 1 0 ) f =( -0.5000000 )
( -1 1 0 ) ( 0.0000000 )
( 0 1 -1 ) ( 0.5000000 )
cart. s(10) = ( 0.5000000 -0.8660254 -0.0000000 ) f =( -0.2500000 )
( 0.8660254 0.5000000 -0.0000000 ) ( 0.1443376 )
( 0.0000000 0.0000000 -1.0000000 ) ( 0.4082483 )
isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0]
cryst. s(11) = ( 0 1 0 )
( 1 0 0 )
( 0 0 1 )
cart. s(11) = ( 0.5000000 0.8660254 0.0000000 )
( 0.8660254 -0.5000000 0.0000000 )
( 0.0000000 0.0000000 1.0000000 )
isym = 12 inv. 180 deg rotation - cryst. axis [1,1,0]
cryst. s(12) = ( 1 -1 0 ) f =( 0.0000000 )
( 0 -1 0 ) ( -0.5000000 )
( 0 -1 1 ) ( 0.0000000 )
cart. s(12) = ( 0.5000000 -0.8660254 0.0000000 ) f =( -0.2500000 )
( -0.8660254 -0.5000000 0.0000000 ) ( -0.4330127 )
( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 )
double point group D_3d (-3m)
there are 12 classes and 6 irreducible representations
the character table:
E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v
G_4+ 2.00 -2.00 1.00 -1.00 0.00 0.00 2.00 -2.00 1.00 -1.00 0.00 0.00
G_5+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00
G_6+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00
G_4- 2.00 -2.00 1.00 -1.00 0.00 0.00 -2.00 2.00 -1.00 1.00 0.00 0.00
G_5- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00
G_6- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00
imaginary part
E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v
G_4+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00
G_5+ 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00
G_6+ 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 -1.00 1.00
G_4- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00
G_5- 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00
G_6- 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 1.00 -1.00
the symmetry operations in each class and the name of the first element:
E 1
identity
-E -1
identity E
2C3 3 4
120 deg rotation - cryst. axis [0,0,1]
-2C3 -3 -4
120 deg rotation - cryst. axis [0,0,1] E
3C2' 2 5 -6
180 deg rotation - cart. axis [1,0,0]
3C2' 6 -5 -2
180 deg rotation - cryst. axis [1,1,0]
i 7
inversion
-i -7
inversion E
2S6 9 10
inv. 120 deg rotation - cryst. axis [0,0,1]
-2S6 -9 -10
inv. 120 deg rotation - cryst. axis [0,0,1] E
3s_v 8 11 -12
inv. 180 deg rotation - cart. axis [1,0,0]
3s_v 12 -11 -8
inv. 180 deg rotation - cryst. axis [1,1,0]
Cartesian axes
number of k points= 314 Fermi-Dirac smearing, width (Ry)= 0.0010
cart. coord. in units 2pi/alat
k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031847
k( 2) = ( 0.0106383 -0.0061420 0.0086861), wk = 0.0031847
k( 3) = ( 0.0212766 -0.0122841 0.0173723), wk = 0.0031847
k( 4) = ( 0.0319149 -0.0184261 0.0260584), wk = 0.0031847
k( 5) = ( 0.0425532 -0.0245681 0.0347445), wk = 0.0031847
k( 6) = ( 0.0531915 -0.0307101 0.0434307), wk = 0.0031847
k( 7) = ( 0.0638298 -0.0368521 0.0521168), wk = 0.0031847
k( 8) = ( 0.0744681 -0.0429942 0.0608029), wk = 0.0031847
k( 9) = ( 0.0851064 -0.0491362 0.0694891), wk = 0.0031847
k( 10) = ( 0.0957447 -0.0552782 0.0781752), wk = 0.0031847
k( 11) = ( 0.1063830 -0.0614202 0.0868613), wk = 0.0031847
k( 12) = ( 0.1170213 -0.0675623 0.0955475), wk = 0.0031847
k( 13) = ( 0.1276596 -0.0737043 0.1042336), wk = 0.0031847
k( 14) = ( 0.1382979 -0.0798463 0.1129197), wk = 0.0031847
k( 15) = ( 0.1489362 -0.0859883 0.1216059), wk = 0.0031847
k( 16) = ( 0.1595745 -0.0921304 0.1302920), wk = 0.0031847
k( 17) = ( 0.1702128 -0.0982724 0.1389781), wk = 0.0031847
k( 18) = ( 0.1808511 -0.1044144 0.1476643), wk = 0.0031847
k( 19) = ( 0.1914894 -0.1105564 0.1563504), wk = 0.0031847
k( 20) = ( 0.2021277 -0.1166985 0.1650365), wk = 0.0031847
k( 21) = ( 0.2127660 -0.1228405 0.1737227), wk = 0.0031847
k( 22) = ( 0.2234043 -0.1289825 0.1824088), wk = 0.0031847
k( 23) = ( 0.2340425 -0.1351245 0.1910949), wk = 0.0031847
k( 24) = ( 0.2446809 -0.1412666 0.1997811), wk = 0.0031847
k( 25) = ( 0.2553191 -0.1474086 0.2084672), wk = 0.0031847
k( 26) = ( 0.2659574 -0.1535506 0.2171533), wk = 0.0031847
k( 27) = ( 0.2765957 -0.1596926 0.2258395), wk = 0.0031847
k( 28) = ( 0.2872340 -0.1658347 0.2345256), wk = 0.0031847
k( 29) = ( 0.2978723 -0.1719767 0.2432117), wk = 0.0031847
k( 30) = ( 0.3085106 -0.1781187 0.2518979), wk = 0.0031847
k( 31) = ( 0.3191489 -0.1842607 0.2605840), wk = 0.0031847
k( 32) = ( 0.3297872 -0.1904027 0.2692701), wk = 0.0031847
k( 33) = ( 0.3404255 -0.1965448 0.2779563), wk = 0.0031847
k( 34) = ( 0.3510638 -0.2026868 0.2866424), wk = 0.0031847
k( 35) = ( 0.3617021 -0.2088288 0.2953286), wk = 0.0031847
k( 36) = ( 0.3723404 -0.2149708 0.3040147), wk = 0.0031847
k( 37) = ( 0.3829787 -0.2211129 0.3127008), wk = 0.0031847
k( 38) = ( 0.3936170 -0.2272549 0.3213870), wk = 0.0031847
k( 39) = ( 0.4042553 -0.2333969 0.3300731), wk = 0.0031847
k( 40) = ( 0.4148936 -0.2395389 0.3387592), wk = 0.0031847
k( 41) = ( 0.4255319 -0.2456810 0.3474453), wk = 0.0031847
k( 42) = ( 0.4361702 -0.2518230 0.3561315), wk = 0.0031847
k( 43) = ( 0.4468085 -0.2579650 0.3648176), wk = 0.0031847
k( 44) = ( 0.4574468 -0.2641070 0.3735038), wk = 0.0031847
k( 45) = ( 0.4680851 -0.2702491 0.3821899), wk = 0.0031847
k( 46) = ( 0.4787234 -0.2763911 0.3908760), wk = 0.0031847
k( 47) = ( 0.4893617 -0.2825331 0.3995622), wk = 0.0031847
k( 48) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0031847
k( 49) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0031847
k( 50) = ( 0.5000000 -0.2766470 0.4167535), wk = 0.0031847
k( 51) = ( 0.5000000 -0.2646189 0.4252586), wk = 0.0031847
k( 52) = ( 0.5000000 -0.2525907 0.4337638), wk = 0.0031847
k( 53) = ( 0.5000000 -0.2405626 0.4422690), wk = 0.0031847
k( 54) = ( 0.5000000 -0.2285345 0.4507742), wk = 0.0031847
k( 55) = ( 0.5000000 -0.2165064 0.4592793), wk = 0.0031847
k( 56) = ( 0.5000000 -0.2044782 0.4677845), wk = 0.0031847
k( 57) = ( 0.5000000 -0.1924501 0.4762897), wk = 0.0031847
k( 58) = ( 0.5000000 -0.1804220 0.4847948), wk = 0.0031847
k( 59) = ( 0.5000000 -0.1683938 0.4933000), wk = 0.0031847
k( 60) = ( 0.5000000 -0.1563657 0.5018052), wk = 0.0031847
k( 61) = ( 0.5000000 -0.1443376 0.5103104), wk = 0.0031847
k( 62) = ( 0.5000000 -0.1323094 0.5188155), wk = 0.0031847
k( 63) = ( 0.5000000 -0.1202813 0.5273207), wk = 0.0031847
k( 64) = ( 0.5000000 -0.1082532 0.5358259), wk = 0.0031847
k( 65) = ( 0.5000000 -0.0962250 0.5443311), wk = 0.0031847
k( 66) = ( 0.5000000 -0.0841969 0.5528362), wk = 0.0031847
k( 67) = ( 0.5000000 -0.0721688 0.5613414), wk = 0.0031847
k( 68) = ( 0.5000000 -0.0601406 0.5698466), wk = 0.0031847
k( 69) = ( 0.5000000 -0.0481125 0.5783517), wk = 0.0031847
k( 70) = ( 0.5000000 -0.0360844 0.5868569), wk = 0.0031847
k( 71) = ( 0.5000000 -0.0240563 0.5953621), wk = 0.0031847
k( 72) = ( 0.5000000 -0.0120281 0.6038673), wk = 0.0031847
k( 73) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0031847
k( 74) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0031847
k( 75) = ( 0.4926471 0.0127357 0.6123724), wk = 0.0031847
k( 76) = ( 0.4852941 0.0254713 0.6123724), wk = 0.0031847
k( 77) = ( 0.4779412 0.0382070 0.6123724), wk = 0.0031847
k( 78) = ( 0.4705882 0.0509427 0.6123724), wk = 0.0031847
k( 79) = ( 0.4632353 0.0636783 0.6123724), wk = 0.0031847
k( 80) = ( 0.4558823 0.0764140 0.6123724), wk = 0.0031847
k( 81) = ( 0.4485294 0.0891497 0.6123724), wk = 0.0031847
k( 82) = ( 0.4411765 0.1018853 0.6123724), wk = 0.0031847
k( 83) = ( 0.4338235 0.1146210 0.6123724), wk = 0.0031847
k( 84) = ( 0.4264706 0.1273567 0.6123724), wk = 0.0031847
k( 85) = ( 0.4191177 0.1400923 0.6123724), wk = 0.0031847
k( 86) = ( 0.4117647 0.1528280 0.6123724), wk = 0.0031847
k( 87) = ( 0.4044118 0.1655637 0.6123724), wk = 0.0031847
k( 88) = ( 0.3970588 0.1782994 0.6123724), wk = 0.0031847
k( 89) = ( 0.3897059 0.1910350 0.6123724), wk = 0.0031847
k( 90) = ( 0.3823529 0.2037707 0.6123724), wk = 0.0031847
k( 91) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0031847
k( 92) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0031847
k( 93) = ( 0.3675000 0.2121762 0.6001250), wk = 0.0031847
k( 94) = ( 0.3600000 0.2078461 0.5878775), wk = 0.0031847
k( 95) = ( 0.3525000 0.2035160 0.5756301), wk = 0.0031847
k( 96) = ( 0.3450000 0.1991858 0.5633826), wk = 0.0031847
k( 97) = ( 0.3375000 0.1948557 0.5511352), wk = 0.0031847
k( 98) = ( 0.3300000 0.1905256 0.5388877), wk = 0.0031847
k( 99) = ( 0.3225000 0.1861955 0.5266403), wk = 0.0031847
k( 100) = ( 0.3150000 0.1818653 0.5143928), wk = 0.0031847
k( 101) = ( 0.3075000 0.1775352 0.5021454), wk = 0.0031847
k( 102) = ( 0.3000000 0.1732051 0.4898979), wk = 0.0031847
k( 103) = ( 0.2925000 0.1688750 0.4776505), wk = 0.0031847
k( 104) = ( 0.2850000 0.1645448 0.4654031), wk = 0.0031847
k( 105) = ( 0.2775000 0.1602147 0.4531556), wk = 0.0031847
k( 106) = ( 0.2700000 0.1558846 0.4409082), wk = 0.0031847
k( 107) = ( 0.2625000 0.1515544 0.4286607), wk = 0.0031847
k( 108) = ( 0.2550000 0.1472243 0.4164133), wk = 0.0031847
k( 109) = ( 0.2475000 0.1428942 0.4041658), wk = 0.0031847
k( 110) = ( 0.2400000 0.1385641 0.3919184), wk = 0.0031847
k( 111) = ( 0.2325000 0.1342339 0.3796709), wk = 0.0031847
k( 112) = ( 0.2250000 0.1299038 0.3674235), wk = 0.0031847
k( 113) = ( 0.2175000 0.1255737 0.3551760), wk = 0.0031847
k( 114) = ( 0.2100000 0.1212436 0.3429286), wk = 0.0031847
k( 115) = ( 0.2025000 0.1169134 0.3306811), wk = 0.0031847
k( 116) = ( 0.1950000 0.1125833 0.3184337), wk = 0.0031847
k( 117) = ( 0.1875000 0.1082532 0.3061862), wk = 0.0031847
k( 118) = ( 0.1800000 0.1039230 0.2939388), wk = 0.0031847
k( 119) = ( 0.1725000 0.0995929 0.2816913), wk = 0.0031847
k( 120) = ( 0.1650000 0.0952628 0.2694439), wk = 0.0031847
k( 121) = ( 0.1575000 0.0909327 0.2571964), wk = 0.0031847
k( 122) = ( 0.1500000 0.0866025 0.2449490), wk = 0.0031847
k( 123) = ( 0.1425000 0.0822724 0.2327015), wk = 0.0031847
k( 124) = ( 0.1350000 0.0779423 0.2204541), wk = 0.0031847
k( 125) = ( 0.1275000 0.0736122 0.2082066), wk = 0.0031847
k( 126) = ( 0.1200000 0.0692820 0.1959592), wk = 0.0031847
k( 127) = ( 0.1125000 0.0649519 0.1837117), wk = 0.0031847
k( 128) = ( 0.1050000 0.0606218 0.1714643), wk = 0.0031847
k( 129) = ( 0.0975000 0.0562917 0.1592168), wk = 0.0031847
k( 130) = ( 0.0900000 0.0519615 0.1469694), wk = 0.0031847
k( 131) = ( 0.0825000 0.0476314 0.1347219), wk = 0.0031847
k( 132) = ( 0.0750000 0.0433013 0.1224745), wk = 0.0031847
k( 133) = ( 0.0675000 0.0389711 0.1102270), wk = 0.0031847
k( 134) = ( 0.0600000 0.0346410 0.0979796), wk = 0.0031847
k( 135) = ( 0.0525000 0.0303109 0.0857321), wk = 0.0031847
k( 136) = ( 0.0450000 0.0259808 0.0734847), wk = 0.0031847
k( 137) = ( 0.0375000 0.0216506 0.0612372), wk = 0.0031847
k( 138) = ( 0.0300000 0.0173205 0.0489898), wk = 0.0031847
k( 139) = ( 0.0225000 0.0129904 0.0367423), wk = 0.0031847
k( 140) = ( 0.0150000 0.0086603 0.0244949), wk = 0.0031847
k( 141) = ( 0.0075000 0.0043301 0.0122474), wk = 0.0031847
k( 142) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031847
k( 143) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031847
k( 144) = ( 0.0121951 0.0070409 0.0049786), wk = 0.0031847
k( 145) = ( 0.0243902 0.0140817 0.0099573), wk = 0.0031847
k( 146) = ( 0.0365854 0.0211226 0.0149359), wk = 0.0031847
k( 147) = ( 0.0487805 0.0281634 0.0199146), wk = 0.0031847
k( 148) = ( 0.0609756 0.0352043 0.0248932), wk = 0.0031847
k( 149) = ( 0.0731707 0.0422451 0.0298718), wk = 0.0031847
k( 150) = ( 0.0853658 0.0492860 0.0348505), wk = 0.0031847
k( 151) = ( 0.0975610 0.0563269 0.0398291), wk = 0.0031847
k( 152) = ( 0.1097561 0.0633677 0.0448077), wk = 0.0031847
k( 153) = ( 0.1219512 0.0704086 0.0497864), wk = 0.0031847
k( 154) = ( 0.1341463 0.0774494 0.0547650), wk = 0.0031847
k( 155) = ( 0.1463415 0.0844903 0.0597437), wk = 0.0031847
k( 156) = ( 0.1585366 0.0915311 0.0647223), wk = 0.0031847
k( 157) = ( 0.1707317 0.0985720 0.0697009), wk = 0.0031847
k( 158) = ( 0.1829268 0.1056129 0.0746796), wk = 0.0031847
k( 159) = ( 0.1951219 0.1126537 0.0796582), wk = 0.0031847
k( 160) = ( 0.2073171 0.1196946 0.0846368), wk = 0.0031847
k( 161) = ( 0.2195122 0.1267354 0.0896155), wk = 0.0031847
k( 162) = ( 0.2317073 0.1337763 0.0945941), wk = 0.0031847
k( 163) = ( 0.2439024 0.1408171 0.0995728), wk = 0.0031847
k( 164) = ( 0.2560976 0.1478580 0.1045514), wk = 0.0031847
k( 165) = ( 0.2682927 0.1548989 0.1095300), wk = 0.0031847
k( 166) = ( 0.2804878 0.1619397 0.1145087), wk = 0.0031847
k( 167) = ( 0.2926829 0.1689806 0.1194873), wk = 0.0031847
k( 168) = ( 0.3048781 0.1760214 0.1244659), wk = 0.0031847
k( 169) = ( 0.3170732 0.1830623 0.1294446), wk = 0.0031847
k( 170) = ( 0.3292683 0.1901031 0.1344232), wk = 0.0031847
k( 171) = ( 0.3414634 0.1971440 0.1394019), wk = 0.0031847
k( 172) = ( 0.3536585 0.2041849 0.1443805), wk = 0.0031847
k( 173) = ( 0.3658537 0.2112257 0.1493591), wk = 0.0031847
k( 174) = ( 0.3780488 0.2182666 0.1543378), wk = 0.0031847
k( 175) = ( 0.3902439 0.2253074 0.1593164), wk = 0.0031847
k( 176) = ( 0.4024390 0.2323483 0.1642950), wk = 0.0031847
k( 177) = ( 0.4146341 0.2393891 0.1692737), wk = 0.0031847
k( 178) = ( 0.4268293 0.2464300 0.1742523), wk = 0.0031847
k( 179) = ( 0.4390244 0.2534708 0.1792310), wk = 0.0031847
k( 180) = ( 0.4512195 0.2605117 0.1842096), wk = 0.0031847
k( 181) = ( 0.4634146 0.2675526 0.1891882), wk = 0.0031847
k( 182) = ( 0.4756098 0.2745934 0.1941669), wk = 0.0031847
k( 183) = ( 0.4878049 0.2816343 0.1991455), wk = 0.0031847
k( 184) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0031847
k( 185) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0031847
k( 186) = ( 0.5043103 0.2762322 0.2111629), wk = 0.0031847
k( 187) = ( 0.5086207 0.2637893 0.2182017), wk = 0.0031847
k( 188) = ( 0.5129310 0.2513465 0.2252404), wk = 0.0031847
k( 189) = ( 0.5172414 0.2389036 0.2322792), wk = 0.0031847
k( 190) = ( 0.5215517 0.2264607 0.2393180), wk = 0.0031847
k( 191) = ( 0.5258621 0.2140178 0.2463567), wk = 0.0031847
k( 192) = ( 0.5301724 0.2015749 0.2533955), wk = 0.0031847
k( 193) = ( 0.5344828 0.1891320 0.2604343), wk = 0.0031847
k( 194) = ( 0.5387931 0.1766891 0.2674730), wk = 0.0031847
k( 195) = ( 0.5431035 0.1642462 0.2745118), wk = 0.0031847
k( 196) = ( 0.5474138 0.1518033 0.2815505), wk = 0.0031847
k( 197) = ( 0.5517241 0.1393604 0.2885893), wk = 0.0031847
k( 198) = ( 0.5560345 0.1269175 0.2956281), wk = 0.0031847
k( 199) = ( 0.5603448 0.1144746 0.3026668), wk = 0.0031847
k( 200) = ( 0.5646552 0.1020317 0.3097056), wk = 0.0031847
k( 201) = ( 0.5689655 0.0895888 0.3167444), wk = 0.0031847
k( 202) = ( 0.5732759 0.0771459 0.3237831), wk = 0.0031847
k( 203) = ( 0.5775862 0.0647030 0.3308219), wk = 0.0031847
k( 204) = ( 0.5818965 0.0522602 0.3378607), wk = 0.0031847
k( 205) = ( 0.5862069 0.0398173 0.3448994), wk = 0.0031847
k( 206) = ( 0.5905172 0.0273744 0.3519382), wk = 0.0031847
k( 207) = ( 0.5948276 0.0149315 0.3589769), wk = 0.0031847
k( 208) = ( 0.5991379 0.0024886 0.3660157), wk = 0.0031847
k( 209) = ( 0.6034483 -0.0099543 0.3730545), wk = 0.0031847
k( 210) = ( 0.6077586 -0.0223972 0.3800932), wk = 0.0031847
k( 211) = ( 0.6120690 -0.0348401 0.3871320), wk = 0.0031847
k( 212) = ( 0.6163793 -0.0472830 0.3941708), wk = 0.0031847
k( 213) = ( 0.6206897 -0.0597259 0.4012095), wk = 0.0031847
k( 214) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0031847
k( 215) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0031847
k( 216) = ( 0.6176471 -0.0679236 0.4202556), wk = 0.0031847
k( 217) = ( 0.6102941 -0.0636783 0.4322629), wk = 0.0031847
k( 218) = ( 0.6029412 -0.0594331 0.4442702), wk = 0.0031847
k( 219) = ( 0.5955882 -0.0551879 0.4562775), wk = 0.0031847
k( 220) = ( 0.5882353 -0.0509427 0.4682848), wk = 0.0031847
k( 221) = ( 0.5808823 -0.0466974 0.4802921), wk = 0.0031847
k( 222) = ( 0.5735294 -0.0424522 0.4922994), wk = 0.0031847
k( 223) = ( 0.5661765 -0.0382070 0.5043067), wk = 0.0031847
k( 224) = ( 0.5588235 -0.0339618 0.5163140), wk = 0.0031847
k( 225) = ( 0.5514706 -0.0297166 0.5283213), wk = 0.0031847
k( 226) = ( 0.5441177 -0.0254713 0.5403286), wk = 0.0031847
k( 227) = ( 0.5367647 -0.0212261 0.5523359), wk = 0.0031847
k( 228) = ( 0.5294118 -0.0169809 0.5643432), wk = 0.0031847
k( 229) = ( 0.5220588 -0.0127357 0.5763505), wk = 0.0031847
k( 230) = ( 0.5147059 -0.0084904 0.5883578), wk = 0.0031847
k( 231) = ( 0.5073529 -0.0042452 0.6003651), wk = 0.0031847
k( 232) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0031847
k( 233) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0031847
k( 234) = ( 0.5000000 0.0087477 0.6000013), wk = 0.0031847
k( 235) = ( 0.5000000 0.0174955 0.5876301), wk = 0.0031847
k( 236) = ( 0.5000000 0.0262432 0.5752590), wk = 0.0031847
k( 237) = ( 0.5000000 0.0349909 0.5628878), wk = 0.0031847
k( 238) = ( 0.5000000 0.0437387 0.5505166), wk = 0.0031847
k( 239) = ( 0.5000000 0.0524864 0.5381455), wk = 0.0031847
k( 240) = ( 0.5000000 0.0612341 0.5257743), wk = 0.0031847
k( 241) = ( 0.5000000 0.0699819 0.5134032), wk = 0.0031847
k( 242) = ( 0.5000000 0.0787296 0.5010320), wk = 0.0031847
k( 243) = ( 0.5000000 0.0874773 0.4886608), wk = 0.0031847
k( 244) = ( 0.5000000 0.0962250 0.4762897), wk = 0.0031847
k( 245) = ( 0.5000000 0.1049728 0.4639185), wk = 0.0031847
k( 246) = ( 0.5000000 0.1137205 0.4515473), wk = 0.0031847
k( 247) = ( 0.5000000 0.1224682 0.4391762), wk = 0.0031847
k( 248) = ( 0.5000000 0.1312160 0.4268050), wk = 0.0031847
k( 249) = ( 0.5000000 0.1399637 0.4144339), wk = 0.0031847
k( 250) = ( 0.5000000 0.1487114 0.4020627), wk = 0.0031847
k( 251) = ( 0.5000000 0.1574592 0.3896915), wk = 0.0031847
k( 252) = ( 0.5000000 0.1662069 0.3773204), wk = 0.0031847
k( 253) = ( 0.5000000 0.1749546 0.3649492), wk = 0.0031847
k( 254) = ( 0.5000000 0.1837024 0.3525781), wk = 0.0031847
k( 255) = ( 0.5000000 0.1924501 0.3402069), wk = 0.0031847
k( 256) = ( 0.5000000 0.2011978 0.3278358), wk = 0.0031847
k( 257) = ( 0.5000000 0.2099456 0.3154646), wk = 0.0031847
k( 258) = ( 0.5000000 0.2186933 0.3030934), wk = 0.0031847
k( 259) = ( 0.5000000 0.2274410 0.2907223), wk = 0.0031847
k( 260) = ( 0.5000000 0.2361887 0.2783511), wk = 0.0031847
k( 261) = ( 0.5000000 0.2449365 0.2659800), wk = 0.0031847
k( 262) = ( 0.5000000 0.2536842 0.2536088), wk = 0.0031847
k( 263) = ( 0.5000000 0.2624319 0.2412376), wk = 0.0031847
k( 264) = ( 0.5000000 0.2711797 0.2288665), wk = 0.0031847
k( 265) = ( 0.5000000 0.2799274 0.2164953), wk = 0.0031847
k( 266) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0031847
k( 267) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0031847
k( 268) = ( 0.4956897 0.2861866 0.2182017), wk = 0.0031847
k( 269) = ( 0.4913793 0.2836980 0.2322792), wk = 0.0031847
k( 270) = ( 0.4870690 0.2812094 0.2463567), wk = 0.0031847
k( 271) = ( 0.4827586 0.2787208 0.2604343), wk = 0.0031847
k( 272) = ( 0.4784483 0.2762322 0.2745118), wk = 0.0031847
k( 273) = ( 0.4741379 0.2737437 0.2885893), wk = 0.0031847
k( 274) = ( 0.4698276 0.2712551 0.3026668), wk = 0.0031847
k( 275) = ( 0.4655172 0.2687665 0.3167444), wk = 0.0031847
k( 276) = ( 0.4612069 0.2662779 0.3308219), wk = 0.0031847
k( 277) = ( 0.4568966 0.2637893 0.3448994), wk = 0.0031847
k( 278) = ( 0.4525862 0.2613008 0.3589769), wk = 0.0031847
k( 279) = ( 0.4482759 0.2588122 0.3730545), wk = 0.0031847
k( 280) = ( 0.4439655 0.2563236 0.3871320), wk = 0.0031847
k( 281) = ( 0.4396552 0.2538350 0.4012095), wk = 0.0031847
k( 282) = ( 0.4353448 0.2513465 0.4152870), wk = 0.0031847
k( 283) = ( 0.4310345 0.2488579 0.4293646), wk = 0.0031847
k( 284) = ( 0.4267241 0.2463693 0.4434421), wk = 0.0031847
k( 285) = ( 0.4224138 0.2438807 0.4575196), wk = 0.0031847
k( 286) = ( 0.4181034 0.2413921 0.4715972), wk = 0.0031847
k( 287) = ( 0.4137931 0.2389036 0.4856747), wk = 0.0031847
k( 288) = ( 0.4094828 0.2364150 0.4997522), wk = 0.0031847
k( 289) = ( 0.4051724 0.2339264 0.5138297), wk = 0.0031847
k( 290) = ( 0.4008621 0.2314378 0.5279073), wk = 0.0031847
k( 291) = ( 0.3965517 0.2289492 0.5419848), wk = 0.0031847
k( 292) = ( 0.3922414 0.2264607 0.5560623), wk = 0.0031847
k( 293) = ( 0.3879310 0.2239721 0.5701399), wk = 0.0031847
k( 294) = ( 0.3836207 0.2214835 0.5842174), wk = 0.0031847
k( 295) = ( 0.3793103 0.2189949 0.5982949), wk = 0.0031847
k( 296) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0031847
k( 297) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0031847
k( 298) = ( 0.6176471 -0.0849044 0.4082483), wk = 0.0031847
k( 299) = ( 0.6102941 -0.0976401 0.4082483), wk = 0.0031847
k( 300) = ( 0.6029412 -0.1103758 0.4082483), wk = 0.0031847
k( 301) = ( 0.5955882 -0.1231115 0.4082483), wk = 0.0031847
k( 302) = ( 0.5882353 -0.1358471 0.4082483), wk = 0.0031847
k( 303) = ( 0.5808823 -0.1485828 0.4082483), wk = 0.0031847
k( 304) = ( 0.5735294 -0.1613185 0.4082483), wk = 0.0031847
k( 305) = ( 0.5661765 -0.1740541 0.4082483), wk = 0.0031847
k( 306) = ( 0.5588235 -0.1867898 0.4082483), wk = 0.0031847
k( 307) = ( 0.5514706 -0.1995255 0.4082483), wk = 0.0031847
k( 308) = ( 0.5441177 -0.2122611 0.4082483), wk = 0.0031847
k( 309) = ( 0.5367647 -0.2249968 0.4082483), wk = 0.0031847
k( 310) = ( 0.5294118 -0.2377325 0.4082483), wk = 0.0031847
k( 311) = ( 0.5220588 -0.2504681 0.4082483), wk = 0.0031847
k( 312) = ( 0.5147059 -0.2632038 0.4082483), wk = 0.0031847
k( 313) = ( 0.5073529 -0.2759395 0.4082483), wk = 0.0031847
k( 314) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0031847
cryst. coord.
k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031847
k( 2) = ( 0.0106383 -0.0000000 0.0106383), wk = 0.0031847
k( 3) = ( 0.0212766 -0.0000000 0.0212766), wk = 0.0031847
k( 4) = ( 0.0319149 -0.0000000 0.0319149), wk = 0.0031847
k( 5) = ( 0.0425532 -0.0000000 0.0425532), wk = 0.0031847
k( 6) = ( 0.0531915 -0.0000000 0.0531915), wk = 0.0031847
k( 7) = ( 0.0638298 0.0000000 0.0638298), wk = 0.0031847
k( 8) = ( 0.0744681 0.0000000 0.0744681), wk = 0.0031847
k( 9) = ( 0.0851064 -0.0000000 0.0851064), wk = 0.0031847
k( 10) = ( 0.0957447 -0.0000000 0.0957447), wk = 0.0031847
k( 11) = ( 0.1063830 -0.0000000 0.1063830), wk = 0.0031847
k( 12) = ( 0.1170213 -0.0000000 0.1170213), wk = 0.0031847
k( 13) = ( 0.1276596 0.0000000 0.1276596), wk = 0.0031847
k( 14) = ( 0.1382979 0.0000000 0.1382979), wk = 0.0031847
k( 15) = ( 0.1489362 0.0000000 0.1489362), wk = 0.0031847
k( 16) = ( 0.1595745 0.0000000 0.1595745), wk = 0.0031847
k( 17) = ( 0.1702128 -0.0000000 0.1702128), wk = 0.0031847
k( 18) = ( 0.1808511 -0.0000000 0.1808511), wk = 0.0031847
k( 19) = ( 0.1914894 -0.0000000 0.1914894), wk = 0.0031847
k( 20) = ( 0.2021277 -0.0000000 0.2021277), wk = 0.0031847
k( 21) = ( 0.2127660 -0.0000000 0.2127660), wk = 0.0031847
k( 22) = ( 0.2234043 -0.0000000 0.2234043), wk = 0.0031847
k( 23) = ( 0.2340425 -0.0000000 0.2340425), wk = 0.0031847
k( 24) = ( 0.2446809 -0.0000000 0.2446809), wk = 0.0031847
k( 25) = ( 0.2553191 0.0000000 0.2553192), wk = 0.0031847
k( 26) = ( 0.2659574 0.0000000 0.2659574), wk = 0.0031847
k( 27) = ( 0.2765957 0.0000000 0.2765957), wk = 0.0031847
k( 28) = ( 0.2872340 0.0000000 0.2872340), wk = 0.0031847
k( 29) = ( 0.2978723 0.0000000 0.2978723), wk = 0.0031847
k( 30) = ( 0.3085106 0.0000000 0.3085106), wk = 0.0031847
k( 31) = ( 0.3191489 0.0000000 0.3191489), wk = 0.0031847
k( 32) = ( 0.3297872 0.0000000 0.3297872), wk = 0.0031847
k( 33) = ( 0.3404255 0.0000000 0.3404255), wk = 0.0031847
k( 34) = ( 0.3510638 0.0000000 0.3510638), wk = 0.0031847
k( 35) = ( 0.3617021 0.0000000 0.3617021), wk = 0.0031847
k( 36) = ( 0.3723404 -0.0000000 0.3723404), wk = 0.0031847
k( 37) = ( 0.3829787 -0.0000000 0.3829787), wk = 0.0031847
k( 38) = ( 0.3936170 -0.0000000 0.3936170), wk = 0.0031847
k( 39) = ( 0.4042553 -0.0000000 0.4042553), wk = 0.0031847
k( 40) = ( 0.4148936 -0.0000000 0.4148936), wk = 0.0031847
k( 41) = ( 0.4255319 -0.0000000 0.4255319), wk = 0.0031847
k( 42) = ( 0.4361702 -0.0000000 0.4361702), wk = 0.0031847
k( 43) = ( 0.4468085 -0.0000000 0.4468085), wk = 0.0031847
k( 44) = ( 0.4574468 -0.0000000 0.4574468), wk = 0.0031847
k( 45) = ( 0.4680851 -0.0000000 0.4680851), wk = 0.0031847
k( 46) = ( 0.4787234 -0.0000000 0.4787234), wk = 0.0031847
k( 47) = ( 0.4893617 -0.0000000 0.4893617), wk = 0.0031847
k( 48) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0031847
k( 49) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0031847
k( 50) = ( 0.5000000 0.0104167 0.5104167), wk = 0.0031847
k( 51) = ( 0.5000000 0.0208333 0.5208333), wk = 0.0031847
k( 52) = ( 0.5000000 0.0312500 0.5312500), wk = 0.0031847
k( 53) = ( 0.5000000 0.0416667 0.5416667), wk = 0.0031847
k( 54) = ( 0.5000000 0.0520833 0.5520833), wk = 0.0031847
k( 55) = ( 0.5000000 0.0625000 0.5625000), wk = 0.0031847
k( 56) = ( 0.5000000 0.0729167 0.5729167), wk = 0.0031847
k( 57) = ( 0.5000000 0.0833333 0.5833333), wk = 0.0031847
k( 58) = ( 0.5000000 0.0937500 0.5937500), wk = 0.0031847
k( 59) = ( 0.5000000 0.1041667 0.6041667), wk = 0.0031847
k( 60) = ( 0.5000000 0.1145833 0.6145833), wk = 0.0031847
k( 61) = ( 0.5000000 0.1250000 0.6250000), wk = 0.0031847
k( 62) = ( 0.5000000 0.1354167 0.6354167), wk = 0.0031847
k( 63) = ( 0.5000000 0.1458333 0.6458333), wk = 0.0031847
k( 64) = ( 0.5000000 0.1562500 0.6562500), wk = 0.0031847
k( 65) = ( 0.5000000 0.1666667 0.6666667), wk = 0.0031847
k( 66) = ( 0.5000000 0.1770833 0.6770833), wk = 0.0031847
k( 67) = ( 0.5000000 0.1875000 0.6875000), wk = 0.0031847
k( 68) = ( 0.5000000 0.1979167 0.6979167), wk = 0.0031847
k( 69) = ( 0.5000000 0.2083333 0.7083333), wk = 0.0031847
k( 70) = ( 0.5000000 0.2187500 0.7187500), wk = 0.0031847
k( 71) = ( 0.5000000 0.2291667 0.7291667), wk = 0.0031847
k( 72) = ( 0.5000000 0.2395833 0.7395833), wk = 0.0031847
k( 73) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0031847
k( 74) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0031847
k( 75) = ( 0.4926471 0.2573529 0.7500000), wk = 0.0031847
k( 76) = ( 0.4852941 0.2647059 0.7500000), wk = 0.0031847
k( 77) = ( 0.4779412 0.2720588 0.7500000), wk = 0.0031847
k( 78) = ( 0.4705882 0.2794118 0.7500000), wk = 0.0031847
k( 79) = ( 0.4632353 0.2867647 0.7500000), wk = 0.0031847
k( 80) = ( 0.4558823 0.2941177 0.7500000), wk = 0.0031847
k( 81) = ( 0.4485294 0.3014706 0.7500000), wk = 0.0031847
k( 82) = ( 0.4411765 0.3088235 0.7500000), wk = 0.0031847
k( 83) = ( 0.4338235 0.3161765 0.7500000), wk = 0.0031847
k( 84) = ( 0.4264706 0.3235294 0.7500000), wk = 0.0031847
k( 85) = ( 0.4191177 0.3308824 0.7500000), wk = 0.0031847
k( 86) = ( 0.4117647 0.3382353 0.7500000), wk = 0.0031847
k( 87) = ( 0.4044118 0.3455882 0.7500000), wk = 0.0031847
k( 88) = ( 0.3970588 0.3529412 0.7500000), wk = 0.0031847
k( 89) = ( 0.3897059 0.3602941 0.7500000), wk = 0.0031847
k( 90) = ( 0.3823529 0.3676471 0.7500000), wk = 0.0031847
k( 91) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0031847
k( 92) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0031847
k( 93) = ( 0.3675000 0.3675000 0.7350000), wk = 0.0031847
k( 94) = ( 0.3600000 0.3600000 0.7200000), wk = 0.0031847
k( 95) = ( 0.3525000 0.3525000 0.7050000), wk = 0.0031847
k( 96) = ( 0.3450000 0.3450000 0.6900000), wk = 0.0031847
k( 97) = ( 0.3375000 0.3375000 0.6750000), wk = 0.0031847
k( 98) = ( 0.3300000 0.3300000 0.6600000), wk = 0.0031847
k( 99) = ( 0.3225000 0.3225000 0.6450000), wk = 0.0031847
k( 100) = ( 0.3150000 0.3150000 0.6300000), wk = 0.0031847
k( 101) = ( 0.3075000 0.3075000 0.6150000), wk = 0.0031847
k( 102) = ( 0.3000000 0.3000000 0.6000000), wk = 0.0031847
k( 103) = ( 0.2925000 0.2925000 0.5850000), wk = 0.0031847
k( 104) = ( 0.2850000 0.2850000 0.5700000), wk = 0.0031847
k( 105) = ( 0.2775000 0.2775000 0.5550000), wk = 0.0031847
k( 106) = ( 0.2700000 0.2700000 0.5400000), wk = 0.0031847
k( 107) = ( 0.2625000 0.2625000 0.5250000), wk = 0.0031847
k( 108) = ( 0.2550000 0.2550000 0.5100000), wk = 0.0031847
k( 109) = ( 0.2475000 0.2475000 0.4950000), wk = 0.0031847
k( 110) = ( 0.2400000 0.2400000 0.4800000), wk = 0.0031847
k( 111) = ( 0.2325000 0.2325000 0.4650000), wk = 0.0031847
k( 112) = ( 0.2250000 0.2250000 0.4500000), wk = 0.0031847
k( 113) = ( 0.2175000 0.2175000 0.4350000), wk = 0.0031847
k( 114) = ( 0.2100000 0.2100000 0.4200000), wk = 0.0031847
k( 115) = ( 0.2025000 0.2025000 0.4050000), wk = 0.0031847
k( 116) = ( 0.1950000 0.1950000 0.3900000), wk = 0.0031847
k( 117) = ( 0.1875000 0.1875000 0.3750000), wk = 0.0031847
k( 118) = ( 0.1800000 0.1800000 0.3600000), wk = 0.0031847
k( 119) = ( 0.1725000 0.1725000 0.3450000), wk = 0.0031847
k( 120) = ( 0.1650000 0.1650000 0.3300000), wk = 0.0031847
k( 121) = ( 0.1575000 0.1575000 0.3150000), wk = 0.0031847
k( 122) = ( 0.1500000 0.1500000 0.3000000), wk = 0.0031847
k( 123) = ( 0.1425000 0.1425000 0.2850000), wk = 0.0031847
k( 124) = ( 0.1350000 0.1350000 0.2700000), wk = 0.0031847
k( 125) = ( 0.1275000 0.1275000 0.2550000), wk = 0.0031847
k( 126) = ( 0.1200000 0.1200000 0.2400000), wk = 0.0031847
k( 127) = ( 0.1125000 0.1125000 0.2250000), wk = 0.0031847
k( 128) = ( 0.1050000 0.1050000 0.2100000), wk = 0.0031847
k( 129) = ( 0.0975000 0.0975000 0.1950000), wk = 0.0031847
k( 130) = ( 0.0900000 0.0900000 0.1800000), wk = 0.0031847
k( 131) = ( 0.0825000 0.0825000 0.1650000), wk = 0.0031847
k( 132) = ( 0.0750000 0.0750000 0.1500000), wk = 0.0031847
k( 133) = ( 0.0675000 0.0675000 0.1350000), wk = 0.0031847
k( 134) = ( 0.0600000 0.0600000 0.1200000), wk = 0.0031847
k( 135) = ( 0.0525000 0.0525000 0.1050000), wk = 0.0031847
k( 136) = ( 0.0450000 0.0450000 0.0900000), wk = 0.0031847
k( 137) = ( 0.0375000 0.0375000 0.0750000), wk = 0.0031847
k( 138) = ( 0.0300000 0.0300000 0.0600000), wk = 0.0031847
k( 139) = ( 0.0225000 0.0225000 0.0450000), wk = 0.0031847
k( 140) = ( 0.0150000 0.0150000 0.0300000), wk = 0.0031847
k( 141) = ( 0.0075000 0.0075000 0.0150000), wk = 0.0031847
k( 142) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031847
k( 143) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031847
k( 144) = ( 0.0121951 0.0121951 0.0121951), wk = 0.0031847
k( 145) = ( 0.0243902 0.0243902 0.0243902), wk = 0.0031847
k( 146) = ( 0.0365854 0.0365854 0.0365854), wk = 0.0031847
k( 147) = ( 0.0487805 0.0487805 0.0487805), wk = 0.0031847
k( 148) = ( 0.0609756 0.0609756 0.0609756), wk = 0.0031847
k( 149) = ( 0.0731707 0.0731707 0.0731707), wk = 0.0031847
k( 150) = ( 0.0853658 0.0853659 0.0853659), wk = 0.0031847
k( 151) = ( 0.0975610 0.0975610 0.0975610), wk = 0.0031847
k( 152) = ( 0.1097561 0.1097561 0.1097561), wk = 0.0031847
k( 153) = ( 0.1219512 0.1219512 0.1219512), wk = 0.0031847
k( 154) = ( 0.1341463 0.1341463 0.1341463), wk = 0.0031847
k( 155) = ( 0.1463415 0.1463415 0.1463415), wk = 0.0031847
k( 156) = ( 0.1585366 0.1585366 0.1585366), wk = 0.0031847
k( 157) = ( 0.1707317 0.1707317 0.1707317), wk = 0.0031847
k( 158) = ( 0.1829268 0.1829268 0.1829268), wk = 0.0031847
k( 159) = ( 0.1951219 0.1951219 0.1951219), wk = 0.0031847
k( 160) = ( 0.2073171 0.2073171 0.2073171), wk = 0.0031847
k( 161) = ( 0.2195122 0.2195122 0.2195122), wk = 0.0031847
k( 162) = ( 0.2317073 0.2317073 0.2317073), wk = 0.0031847
k( 163) = ( 0.2439024 0.2439024 0.2439024), wk = 0.0031847
k( 164) = ( 0.2560976 0.2560976 0.2560976), wk = 0.0031847
k( 165) = ( 0.2682927 0.2682927 0.2682927), wk = 0.0031847
k( 166) = ( 0.2804878 0.2804878 0.2804878), wk = 0.0031847
k( 167) = ( 0.2926829 0.2926829 0.2926829), wk = 0.0031847
k( 168) = ( 0.3048781 0.3048781 0.3048781), wk = 0.0031847
k( 169) = ( 0.3170732 0.3170732 0.3170732), wk = 0.0031847
k( 170) = ( 0.3292683 0.3292683 0.3292683), wk = 0.0031847
k( 171) = ( 0.3414634 0.3414634 0.3414634), wk = 0.0031847
k( 172) = ( 0.3536585 0.3536585 0.3536585), wk = 0.0031847
k( 173) = ( 0.3658537 0.3658537 0.3658537), wk = 0.0031847
k( 174) = ( 0.3780488 0.3780488 0.3780488), wk = 0.0031847
k( 175) = ( 0.3902439 0.3902439 0.3902439), wk = 0.0031847
k( 176) = ( 0.4024390 0.4024390 0.4024390), wk = 0.0031847
k( 177) = ( 0.4146341 0.4146341 0.4146342), wk = 0.0031847
k( 178) = ( 0.4268293 0.4268293 0.4268293), wk = 0.0031847
k( 179) = ( 0.4390244 0.4390244 0.4390244), wk = 0.0031847
k( 180) = ( 0.4512195 0.4512195 0.4512195), wk = 0.0031847
k( 181) = ( 0.4634146 0.4634146 0.4634146), wk = 0.0031847
k( 182) = ( 0.4756098 0.4756098 0.4756098), wk = 0.0031847
k( 183) = ( 0.4878049 0.4878049 0.4878049), wk = 0.0031847
k( 184) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031847
k( 185) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031847
k( 186) = ( 0.5043103 0.4913793 0.5043103), wk = 0.0031847
k( 187) = ( 0.5086207 0.4827586 0.5086207), wk = 0.0031847
k( 188) = ( 0.5129310 0.4741379 0.5129310), wk = 0.0031847
k( 189) = ( 0.5172414 0.4655172 0.5172414), wk = 0.0031847
k( 190) = ( 0.5215517 0.4568966 0.5215517), wk = 0.0031847
k( 191) = ( 0.5258621 0.4482759 0.5258621), wk = 0.0031847
k( 192) = ( 0.5301724 0.4396552 0.5301724), wk = 0.0031847
k( 193) = ( 0.5344828 0.4310345 0.5344828), wk = 0.0031847
k( 194) = ( 0.5387931 0.4224138 0.5387931), wk = 0.0031847
k( 195) = ( 0.5431035 0.4137931 0.5431035), wk = 0.0031847
k( 196) = ( 0.5474138 0.4051724 0.5474138), wk = 0.0031847
k( 197) = ( 0.5517241 0.3965517 0.5517241), wk = 0.0031847
k( 198) = ( 0.5560345 0.3879310 0.5560345), wk = 0.0031847
k( 199) = ( 0.5603448 0.3793103 0.5603448), wk = 0.0031847
k( 200) = ( 0.5646552 0.3706897 0.5646552), wk = 0.0031847
k( 201) = ( 0.5689655 0.3620690 0.5689655), wk = 0.0031847
k( 202) = ( 0.5732759 0.3534483 0.5732759), wk = 0.0031847
k( 203) = ( 0.5775862 0.3448276 0.5775862), wk = 0.0031847
k( 204) = ( 0.5818965 0.3362069 0.5818966), wk = 0.0031847
k( 205) = ( 0.5862069 0.3275862 0.5862069), wk = 0.0031847
k( 206) = ( 0.5905172 0.3189655 0.5905172), wk = 0.0031847
k( 207) = ( 0.5948276 0.3103448 0.5948276), wk = 0.0031847
k( 208) = ( 0.5991379 0.3017241 0.5991379), wk = 0.0031847
k( 209) = ( 0.6034483 0.2931034 0.6034483), wk = 0.0031847
k( 210) = ( 0.6077586 0.2844828 0.6077586), wk = 0.0031847
k( 211) = ( 0.6120690 0.2758621 0.6120690), wk = 0.0031847
k( 212) = ( 0.6163793 0.2672414 0.6163793), wk = 0.0031847
k( 213) = ( 0.6206897 0.2586207 0.6206897), wk = 0.0031847
k( 214) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0031847
k( 215) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0031847
k( 216) = ( 0.6176471 0.2500000 0.6323529), wk = 0.0031847
k( 217) = ( 0.6102941 0.2500000 0.6397059), wk = 0.0031847
k( 218) = ( 0.6029412 0.2500000 0.6470588), wk = 0.0031847
k( 219) = ( 0.5955882 0.2500000 0.6544118), wk = 0.0031847
k( 220) = ( 0.5882353 0.2500000 0.6617647), wk = 0.0031847
k( 221) = ( 0.5808823 0.2500000 0.6691177), wk = 0.0031847
k( 222) = ( 0.5735294 0.2500000 0.6764706), wk = 0.0031847
k( 223) = ( 0.5661765 0.2500000 0.6838235), wk = 0.0031847
k( 224) = ( 0.5588235 0.2500000 0.6911765), wk = 0.0031847
k( 225) = ( 0.5514706 0.2500000 0.6985294), wk = 0.0031847
k( 226) = ( 0.5441177 0.2500000 0.7058824), wk = 0.0031847
k( 227) = ( 0.5367647 0.2500000 0.7132353), wk = 0.0031847
k( 228) = ( 0.5294118 0.2500000 0.7205882), wk = 0.0031847
k( 229) = ( 0.5220588 0.2500000 0.7279412), wk = 0.0031847
k( 230) = ( 0.5147059 0.2500000 0.7352941), wk = 0.0031847
k( 231) = ( 0.5073529 0.2500000 0.7426471), wk = 0.0031847
k( 232) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0031847
k( 233) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0031847
k( 234) = ( 0.5000000 0.2575758 0.7424242), wk = 0.0031847
k( 235) = ( 0.5000000 0.2651515 0.7348485), wk = 0.0031847
k( 236) = ( 0.5000000 0.2727273 0.7272727), wk = 0.0031847
k( 237) = ( 0.5000000 0.2803030 0.7196970), wk = 0.0031847
k( 238) = ( 0.5000000 0.2878788 0.7121212), wk = 0.0031847
k( 239) = ( 0.5000000 0.2954546 0.7045455), wk = 0.0031847
k( 240) = ( 0.5000000 0.3030303 0.6969697), wk = 0.0031847
k( 241) = ( 0.5000000 0.3106061 0.6893939), wk = 0.0031847
k( 242) = ( 0.5000000 0.3181818 0.6818182), wk = 0.0031847
k( 243) = ( 0.5000000 0.3257576 0.6742424), wk = 0.0031847
k( 244) = ( 0.5000000 0.3333333 0.6666667), wk = 0.0031847
k( 245) = ( 0.5000000 0.3409091 0.6590909), wk = 0.0031847
k( 246) = ( 0.5000000 0.3484849 0.6515152), wk = 0.0031847
k( 247) = ( 0.5000000 0.3560606 0.6439394), wk = 0.0031847
k( 248) = ( 0.5000000 0.3636364 0.6363636), wk = 0.0031847
k( 249) = ( 0.5000000 0.3712121 0.6287879), wk = 0.0031847
k( 250) = ( 0.5000000 0.3787879 0.6212121), wk = 0.0031847
k( 251) = ( 0.5000000 0.3863636 0.6136364), wk = 0.0031847
k( 252) = ( 0.5000000 0.3939394 0.6060606), wk = 0.0031847
k( 253) = ( 0.5000000 0.4015152 0.5984848), wk = 0.0031847
k( 254) = ( 0.5000000 0.4090909 0.5909091), wk = 0.0031847
k( 255) = ( 0.5000000 0.4166667 0.5833333), wk = 0.0031847
k( 256) = ( 0.5000000 0.4242424 0.5757576), wk = 0.0031847
k( 257) = ( 0.5000000 0.4318182 0.5681818), wk = 0.0031847
k( 258) = ( 0.5000000 0.4393939 0.5606061), wk = 0.0031847
k( 259) = ( 0.5000000 0.4469697 0.5530303), wk = 0.0031847
k( 260) = ( 0.5000000 0.4545455 0.5454545), wk = 0.0031847
k( 261) = ( 0.5000000 0.4621212 0.5378788), wk = 0.0031847
k( 262) = ( 0.5000000 0.4696970 0.5303030), wk = 0.0031847
k( 263) = ( 0.5000000 0.4772727 0.5227273), wk = 0.0031847
k( 264) = ( 0.5000000 0.4848485 0.5151515), wk = 0.0031847
k( 265) = ( 0.5000000 0.4924242 0.5075758), wk = 0.0031847
k( 266) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031847
k( 267) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031847
k( 268) = ( 0.4956897 0.4956897 0.5086207), wk = 0.0031847
k( 269) = ( 0.4913793 0.4913793 0.5172414), wk = 0.0031847
k( 270) = ( 0.4870690 0.4870690 0.5258621), wk = 0.0031847
k( 271) = ( 0.4827586 0.4827586 0.5344828), wk = 0.0031847
k( 272) = ( 0.4784483 0.4784483 0.5431035), wk = 0.0031847
k( 273) = ( 0.4741379 0.4741379 0.5517241), wk = 0.0031847
k( 274) = ( 0.4698276 0.4698276 0.5603448), wk = 0.0031847
k( 275) = ( 0.4655172 0.4655172 0.5689655), wk = 0.0031847
k( 276) = ( 0.4612069 0.4612069 0.5775862), wk = 0.0031847
k( 277) = ( 0.4568966 0.4568966 0.5862069), wk = 0.0031847
k( 278) = ( 0.4525862 0.4525862 0.5948276), wk = 0.0031847
k( 279) = ( 0.4482759 0.4482759 0.6034483), wk = 0.0031847
k( 280) = ( 0.4439655 0.4439655 0.6120690), wk = 0.0031847
k( 281) = ( 0.4396552 0.4396552 0.6206897), wk = 0.0031847
k( 282) = ( 0.4353448 0.4353448 0.6293103), wk = 0.0031847
k( 283) = ( 0.4310345 0.4310345 0.6379310), wk = 0.0031847
k( 284) = ( 0.4267241 0.4267241 0.6465517), wk = 0.0031847
k( 285) = ( 0.4224138 0.4224138 0.6551724), wk = 0.0031847
k( 286) = ( 0.4181034 0.4181034 0.6637931), wk = 0.0031847
k( 287) = ( 0.4137931 0.4137931 0.6724138), wk = 0.0031847
k( 288) = ( 0.4094828 0.4094828 0.6810345), wk = 0.0031847
k( 289) = ( 0.4051724 0.4051724 0.6896552), wk = 0.0031847
k( 290) = ( 0.4008621 0.4008621 0.6982759), wk = 0.0031847
k( 291) = ( 0.3965517 0.3965517 0.7068966), wk = 0.0031847
k( 292) = ( 0.3922414 0.3922414 0.7155172), wk = 0.0031847
k( 293) = ( 0.3879310 0.3879310 0.7241379), wk = 0.0031847
k( 294) = ( 0.3836207 0.3836207 0.7327586), wk = 0.0031847
k( 295) = ( 0.3793103 0.3793103 0.7413793), wk = 0.0031847
k( 296) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0031847
k( 297) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0031847
k( 298) = ( 0.6176471 0.2352941 0.6176471), wk = 0.0031847
k( 299) = ( 0.6102941 0.2205882 0.6102941), wk = 0.0031847
k( 300) = ( 0.6029412 0.2058823 0.6029412), wk = 0.0031847
k( 301) = ( 0.5955882 0.1911765 0.5955882), wk = 0.0031847
k( 302) = ( 0.5882353 0.1764706 0.5882353), wk = 0.0031847
k( 303) = ( 0.5808823 0.1617647 0.5808824), wk = 0.0031847
k( 304) = ( 0.5735294 0.1470588 0.5735294), wk = 0.0031847
k( 305) = ( 0.5661765 0.1323529 0.5661765), wk = 0.0031847
k( 306) = ( 0.5588235 0.1176471 0.5588235), wk = 0.0031847
k( 307) = ( 0.5514706 0.1029412 0.5514706), wk = 0.0031847
k( 308) = ( 0.5441177 0.0882353 0.5441177), wk = 0.0031847
k( 309) = ( 0.5367647 0.0735294 0.5367647), wk = 0.0031847
k( 310) = ( 0.5294118 0.0588235 0.5294118), wk = 0.0031847
k( 311) = ( 0.5220588 0.0441176 0.5220588), wk = 0.0031847
k( 312) = ( 0.5147059 0.0294118 0.5147059), wk = 0.0031847
k( 313) = ( 0.5073529 0.0147059 0.5073529), wk = 0.0031847
k( 314) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0031847
Dense grid: 74825 G-vectors FFT dimensions: ( 60, 60, 60)
Largest allocated arrays est. size (Mb) dimensions
Kohn-Sham Wavefunctions 0.32 Mb ( 528, 40)
NL pseudopotentials 0.39 Mb ( 264, 96)
Each V/rho on FFT grid 0.11 Mb ( 7200)
Each G-vector array 0.02 Mb ( 2079)
G-vector shells 0.00 Mb ( 487)
Largest temporary arrays est. size (Mb) dimensions
Auxiliary wavefunctions 1.29 Mb ( 528, 160)
Each subspace H/S matrix 0.02 Mb ( 40, 40)
Each <psi_i|beta_j> matrix 0.12 Mb ( 96, 2, 40)
The potential is recalculated from file :
./LiIn.save/charge-density.dat
Starting wfc are 56 randomized atomic wfcs
Band Structure Calculation
Davidson diagonalization with overlap
Computing kpt #: 1
total cpu time spent up to now is 1.9 secs
Computing kpt #: 2
total cpu time spent up to now is 2.4 secs
Computing kpt #: 3
total cpu time spent up to now is 2.9 secs
Computing kpt #: 4
total cpu time spent up to now is 3.4 secs
Computing kpt #: 5
total cpu time spent up to now is 3.9 secs
Computing kpt #: 6
total cpu time spent up to now is 4.4 secs
Computing kpt #: 7
total cpu time spent up to now is 4.9 secs
Computing kpt #: 8
total cpu time spent up to now is 5.4 secs
Computing kpt #: 9
total cpu time spent up to now is 5.9 secs
Computing kpt #: 10
total cpu time spent up to now is 6.4 secs
Computing kpt #: 11
total cpu time spent up to now is 7.0 secs
Computing kpt #: 12
total cpu time spent up to now is 7.5 secs
Computing kpt #: 13
total cpu time spent up to now is 8.1 secs
Computing kpt #: 14
total cpu time spent up to now is 8.7 secs
Computing kpt #: 15
total cpu time spent up to now is 9.3 secs
Computing kpt #: 16
total cpu time spent up to now is 9.8 secs
Computing kpt #: 17
total cpu time spent up to now is 10.4 secs
Computing kpt #: 18
total cpu time spent up to now is 10.9 secs
Computing kpt #: 19
total cpu time spent up to now is 11.4 secs
Computing kpt #: 20
total cpu time spent up to now is 12.0 secs
Computing kpt #: 21
total cpu time spent up to now is 12.5 secs
Computing kpt #: 22
total cpu time spent up to now is 13.0 secs
Computing kpt #: 23
total cpu time spent up to now is 13.5 secs
Computing kpt #: 24
total cpu time spent up to now is 14.0 secs
Computing kpt #: 25
total cpu time spent up to now is 14.5 secs
Computing kpt #: 26
total cpu time spent up to now is 15.0 secs
Computing kpt #: 27
total cpu time spent up to now is 15.5 secs
Computing kpt #: 28
total cpu time spent up to now is 15.9 secs
Computing kpt #: 29
total cpu time spent up to now is 16.4 secs
Computing kpt #: 30
total cpu time spent up to now is 16.9 secs
Computing kpt #: 31
total cpu time spent up to now is 17.4 secs
Computing kpt #: 32
total cpu time spent up to now is 17.8 secs
Computing kpt #: 33
total cpu time spent up to now is 18.3 secs
Computing kpt #: 34
total cpu time spent up to now is 18.8 secs
Computing kpt #: 35
total cpu time spent up to now is 19.2 secs
Computing kpt #: 36
total cpu time spent up to now is 19.7 secs
Computing kpt #: 37
total cpu time spent up to now is 20.2 secs
Computing kpt #: 38
total cpu time spent up to now is 20.7 secs
Computing kpt #: 39
total cpu time spent up to now is 21.2 secs
Computing kpt #: 40
total cpu time spent up to now is 21.6 secs
Computing kpt #: 41
total cpu time spent up to now is 22.1 secs
Computing kpt #: 42
total cpu time spent up to now is 22.6 secs
Computing kpt #: 43
total cpu time spent up to now is 23.1 secs
Computing kpt #: 44
total cpu time spent up to now is 23.6 secs
Computing kpt #: 45
total cpu time spent up to now is 24.2 secs
Computing kpt #: 46
total cpu time spent up to now is 24.8 secs
Computing kpt #: 47
total cpu time spent up to now is 25.4 secs
Computing kpt #: 48
total cpu time spent up to now is 26.0 secs
Computing kpt #: 49
total cpu time spent up to now is 26.5 secs
Computing kpt #: 50
total cpu time spent up to now is 27.1 secs
Computing kpt #: 51
total cpu time spent up to now is 27.7 secs
Computing kpt #: 52
total cpu time spent up to now is 28.3 secs
Computing kpt #: 53
total cpu time spent up to now is 28.9 secs
Computing kpt #: 54
total cpu time spent up to now is 29.4 secs
Computing kpt #: 55
total cpu time spent up to now is 29.9 secs
Computing kpt #: 56
total cpu time spent up to now is 30.4 secs
Computing kpt #: 57
total cpu time spent up to now is 31.0 secs
Computing kpt #: 58
total cpu time spent up to now is 31.4 secs
Computing kpt #: 59
total cpu time spent up to now is 31.9 secs
Computing kpt #: 60
total cpu time spent up to now is 32.4 secs
Computing kpt #: 61
total cpu time spent up to now is 32.9 secs
Computing kpt #: 62
total cpu time spent up to now is 33.3 secs
Computing kpt #: 63
total cpu time spent up to now is 33.8 secs
Computing kpt #: 64
total cpu time spent up to now is 34.3 secs
Computing kpt #: 65
total cpu time spent up to now is 34.7 secs
Computing kpt #: 66
total cpu time spent up to now is 35.2 secs
Computing kpt #: 67
total cpu time spent up to now is 35.6 secs
Computing kpt #: 68
total cpu time spent up to now is 36.1 secs
Computing kpt #: 69
total cpu time spent up to now is 36.5 secs
Computing kpt #: 70
total cpu time spent up to now is 36.9 secs
Computing kpt #: 71
total cpu time spent up to now is 37.4 secs
Computing kpt #: 72
total cpu time spent up to now is 37.8 secs
Computing kpt #: 73
total cpu time spent up to now is 38.2 secs
Computing kpt #: 74
total cpu time spent up to now is 38.6 secs
Computing kpt #: 75
total cpu time spent up to now is 39.1 secs
Computing kpt #: 76
total cpu time spent up to now is 39.5 secs
Computing kpt #: 77
total cpu time spent up to now is 39.9 secs
Computing kpt #: 78
total cpu time spent up to now is 40.3 secs
Computing kpt #: 79
total cpu time spent up to now is 40.8 secs
Computing kpt #: 80
total cpu time spent up to now is 41.2 secs
Computing kpt #: 81
total cpu time spent up to now is 41.7 secs
Computing kpt #: 82
total cpu time spent up to now is 42.2 secs
Computing kpt #: 83
total cpu time spent up to now is 42.6 secs
Computing kpt #: 84
total cpu time spent up to now is 43.1 secs
Computing kpt #: 85
total cpu time spent up to now is 43.6 secs
Computing kpt #: 86
total cpu time spent up to now is 44.0 secs
Computing kpt #: 87
total cpu time spent up to now is 44.5 secs
Computing kpt #: 88
total cpu time spent up to now is 45.0 secs
Computing kpt #: 89
total cpu time spent up to now is 45.5 secs
Computing kpt #: 90
total cpu time spent up to now is 46.1 secs
Computing kpt #: 91
total cpu time spent up to now is 46.6 secs
Computing kpt #: 92
total cpu time spent up to now is 47.1 secs
Computing kpt #: 93
total cpu time spent up to now is 47.6 secs
Computing kpt #: 94
total cpu time spent up to now is 48.2 secs
Computing kpt #: 95
total cpu time spent up to now is 48.7 secs
Computing kpt #: 96
total cpu time spent up to now is 49.2 secs
Computing kpt #: 97
total cpu time spent up to now is 49.7 secs
Computing kpt #: 98
total cpu time spent up to now is 50.3 secs
Computing kpt #: 99
total cpu time spent up to now is 50.8 secs
Computing kpt #: 100
total cpu time spent up to now is 51.3 secs
Computing kpt #: 101
total cpu time spent up to now is 51.8 secs
Computing kpt #: 102
total cpu time spent up to now is 52.4 secs
Computing kpt #: 103
total cpu time spent up to now is 52.9 secs
Computing kpt #: 104
total cpu time spent up to now is 53.4 secs
Computing kpt #: 105
total cpu time spent up to now is 54.0 secs
Computing kpt #: 106
total cpu time spent up to now is 54.5 secs
Computing kpt #: 107
total cpu time spent up to now is 55.0 secs
Computing kpt #: 108
total cpu time spent up to now is 55.6 secs
Computing kpt #: 109
total cpu time spent up to now is 56.1 secs
Computing kpt #: 110
total cpu time spent up to now is 56.7 secs
Computing kpt #: 111
total cpu time spent up to now is 57.2 secs
Computing kpt #: 112
total cpu time spent up to now is 57.7 secs
Computing kpt #: 113
total cpu time spent up to now is 58.3 secs
Computing kpt #: 114
total cpu time spent up to now is 58.8 secs
Computing kpt #: 115
total cpu time spent up to now is 59.4 secs
Computing kpt #: 116
total cpu time spent up to now is 59.9 secs
Computing kpt #: 117
total cpu time spent up to now is 60.5 secs
Computing kpt #: 118
total cpu time spent up to now is 61.0 secs
Computing kpt #: 119
total cpu time spent up to now is 61.5 secs
Computing kpt #: 120
total cpu time spent up to now is 62.0 secs
Computing kpt #: 121
total cpu time spent up to now is 62.6 secs
Computing kpt #: 122
total cpu time spent up to now is 63.1 secs
Computing kpt #: 123
total cpu time spent up to now is 63.6 secs
Computing kpt #: 124
total cpu time spent up to now is 64.2 secs
Computing kpt #: 125
total cpu time spent up to now is 64.7 secs
Computing kpt #: 126
total cpu time spent up to now is 65.2 secs
Computing kpt #: 127
total cpu time spent up to now is 65.7 secs
Computing kpt #: 128
total cpu time spent up to now is 66.3 secs
Computing kpt #: 129
total cpu time spent up to now is 66.9 secs
Computing kpt #: 130
total cpu time spent up to now is 67.5 secs
Computing kpt #: 131
total cpu time spent up to now is 68.0 secs
Computing kpt #: 132
total cpu time spent up to now is 68.6 secs
Computing kpt #: 133
total cpu time spent up to now is 69.1 secs
Computing kpt #: 134
total cpu time spent up to now is 69.6 secs
Computing kpt #: 135
total cpu time spent up to now is 70.1 secs
Computing kpt #: 136
total cpu time spent up to now is 70.6 secs
Computing kpt #: 137
total cpu time spent up to now is 71.1 secs
Computing kpt #: 138
total cpu time spent up to now is 71.6 secs
Computing kpt #: 139
total cpu time spent up to now is 72.1 secs
Computing kpt #: 140
total cpu time spent up to now is 72.6 secs
Computing kpt #: 141
total cpu time spent up to now is 73.1 secs
Computing kpt #: 142
total cpu time spent up to now is 73.5 secs
Computing kpt #: 143
total cpu time spent up to now is 74.0 secs
Computing kpt #: 144
total cpu time spent up to now is 74.5 secs
Computing kpt #: 145
total cpu time spent up to now is 75.0 secs
Computing kpt #: 146
total cpu time spent up to now is 75.5 secs
Computing kpt #: 147
total cpu time spent up to now is 76.0 secs
Computing kpt #: 148
total cpu time spent up to now is 76.5 secs
Computing kpt #: 149
total cpu time spent up to now is 77.0 secs
Computing kpt #: 150
total cpu time spent up to now is 77.5 secs
Computing kpt #: 151
total cpu time spent up to now is 78.0 secs
Computing kpt #: 152
total cpu time spent up to now is 78.5 secs
Computing kpt #: 153
total cpu time spent up to now is 79.1 secs
Computing kpt #: 154
total cpu time spent up to now is 79.6 secs
Computing kpt #: 155
total cpu time spent up to now is 80.2 secs
Computing kpt #: 156
total cpu time spent up to now is 80.8 secs
Computing kpt #: 157
total cpu time spent up to now is 81.4 secs
Computing kpt #: 158
total cpu time spent up to now is 82.1 secs
Computing kpt #: 159
total cpu time spent up to now is 82.7 secs
Computing kpt #: 160
total cpu time spent up to now is 83.3 secs
Computing kpt #: 161
total cpu time spent up to now is 84.0 secs
Computing kpt #: 162
total cpu time spent up to now is 84.5 secs
Computing kpt #: 163
total cpu time spent up to now is 85.1 secs
Computing kpt #: 164
total cpu time spent up to now is 85.6 secs
Computing kpt #: 165
total cpu time spent up to now is 86.1 secs
Computing kpt #: 166
total cpu time spent up to now is 86.7 secs
Computing kpt #: 167
total cpu time spent up to now is 87.4 secs
Computing kpt #: 168
total cpu time spent up to now is 88.1 secs
Computing kpt #: 169
total cpu time spent up to now is 88.7 secs
Computing kpt #: 170
total cpu time spent up to now is 89.2 secs
Computing kpt #: 171
total cpu time spent up to now is 89.6 secs
Computing kpt #: 172
total cpu time spent up to now is 90.1 secs
Computing kpt #: 173
total cpu time spent up to now is 90.6 secs
Computing kpt #: 174
total cpu time spent up to now is 91.0 secs
Computing kpt #: 175
total cpu time spent up to now is 91.5 secs
Computing kpt #: 176
total cpu time spent up to now is 91.9 secs
Computing kpt #: 177
total cpu time spent up to now is 92.4 secs
Computing kpt #: 178
total cpu time spent up to now is 92.8 secs
Computing kpt #: 179
total cpu time spent up to now is 93.3 secs
Computing kpt #: 180
total cpu time spent up to now is 93.7 secs
Computing kpt #: 181
total cpu time spent up to now is 94.2 secs
Computing kpt #: 182
total cpu time spent up to now is 94.6 secs
Computing kpt #: 183
total cpu time spent up to now is 95.1 secs
Computing kpt #: 184
total cpu time spent up to now is 95.5 secs
Computing kpt #: 185
total cpu time spent up to now is 95.9 secs
Computing kpt #: 186
total cpu time spent up to now is 96.4 secs
Computing kpt #: 187
total cpu time spent up to now is 96.8 secs
Computing kpt #: 188
total cpu time spent up to now is 97.3 secs
Computing kpt #: 189
total cpu time spent up to now is 97.7 secs
Computing kpt #: 190
total cpu time spent up to now is 98.2 secs
Computing kpt #: 191
total cpu time spent up to now is 98.7 secs
Computing kpt #: 192
total cpu time spent up to now is 99.2 secs
Computing kpt #: 193
total cpu time spent up to now is 99.6 secs
Computing kpt #: 194
total cpu time spent up to now is 100.1 secs
Computing kpt #: 195
total cpu time spent up to now is 100.6 secs
Computing kpt #: 196
total cpu time spent up to now is 101.2 secs
Computing kpt #: 197
total cpu time spent up to now is 101.7 secs
Computing kpt #: 198
total cpu time spent up to now is 102.3 secs
Computing kpt #: 199
total cpu time spent up to now is 102.8 secs
Computing kpt #: 200
total cpu time spent up to now is 103.3 secs
Computing kpt #: 201
total cpu time spent up to now is 103.8 secs
Computing kpt #: 202
total cpu time spent up to now is 104.3 secs
Computing kpt #: 203
total cpu time spent up to now is 104.8 secs
Computing kpt #: 204
total cpu time spent up to now is 105.3 secs
Computing kpt #: 205
total cpu time spent up to now is 105.8 secs
Computing kpt #: 206
total cpu time spent up to now is 106.2 secs
Computing kpt #: 207
total cpu time spent up to now is 106.7 secs
Computing kpt #: 208
total cpu time spent up to now is 107.2 secs
Computing kpt #: 209
total cpu time spent up to now is 107.7 secs
Computing kpt #: 210
total cpu time spent up to now is 108.2 secs
Computing kpt #: 211
total cpu time spent up to now is 108.7 secs
Computing kpt #: 212
total cpu time spent up to now is 109.2 secs
Computing kpt #: 213
total cpu time spent up to now is 109.8 secs
Computing kpt #: 214
total cpu time spent up to now is 110.3 secs
Computing kpt #: 215
total cpu time spent up to now is 110.9 secs
Computing kpt #: 216
total cpu time spent up to now is 111.4 secs
Computing kpt #: 217
total cpu time spent up to now is 112.0 secs
Computing kpt #: 218
total cpu time spent up to now is 112.5 secs
Computing kpt #: 219
total cpu time spent up to now is 112.9 secs
Computing kpt #: 220
total cpu time spent up to now is 113.4 secs
Computing kpt #: 221
total cpu time spent up to now is 113.9 secs
Computing kpt #: 222
total cpu time spent up to now is 114.4 secs
Computing kpt #: 223
total cpu time spent up to now is 114.8 secs
Computing kpt #: 224
total cpu time spent up to now is 115.3 secs
Computing kpt #: 225
total cpu time spent up to now is 115.7 secs
Computing kpt #: 226
total cpu time spent up to now is 116.2 secs
Computing kpt #: 227
total cpu time spent up to now is 116.6 secs
Computing kpt #: 228
total cpu time spent up to now is 117.1 secs
Computing kpt #: 229
total cpu time spent up to now is 117.5 secs
Computing kpt #: 230
total cpu time spent up to now is 117.9 secs
Computing kpt #: 231
total cpu time spent up to now is 118.4 secs
Computing kpt #: 232
total cpu time spent up to now is 118.8 secs
Computing kpt #: 233
total cpu time spent up to now is 119.3 secs
Computing kpt #: 234
total cpu time spent up to now is 119.7 secs
Computing kpt #: 235
total cpu time spent up to now is 120.1 secs
Computing kpt #: 236
total cpu time spent up to now is 120.5 secs
Computing kpt #: 237
total cpu time spent up to now is 121.0 secs
Computing kpt #: 238
total cpu time spent up to now is 121.4 secs
Computing kpt #: 239
total cpu time spent up to now is 121.9 secs
Computing kpt #: 240
total cpu time spent up to now is 122.3 secs
Computing kpt #: 241
total cpu time spent up to now is 122.8 secs
Computing kpt #: 242
total cpu time spent up to now is 123.2 secs
Computing kpt #: 243
total cpu time spent up to now is 123.7 secs
Computing kpt #: 244
total cpu time spent up to now is 124.2 secs
Computing kpt #: 245
total cpu time spent up to now is 124.6 secs
Computing kpt #: 246
total cpu time spent up to now is 125.1 secs
Computing kpt #: 247
total cpu time spent up to now is 125.6 secs
Computing kpt #: 248
total cpu time spent up to now is 126.1 secs
Computing kpt #: 249
total cpu time spent up to now is 126.6 secs
Computing kpt #: 250
total cpu time spent up to now is 127.2 secs
Computing kpt #: 251
total cpu time spent up to now is 127.7 secs
Computing kpt #: 252
total cpu time spent up to now is 128.2 secs
Computing kpt #: 253
total cpu time spent up to now is 128.7 secs
Computing kpt #: 254
total cpu time spent up to now is 129.2 secs
Computing kpt #: 255
total cpu time spent up to now is 129.7 secs
Computing kpt #: 256
total cpu time spent up to now is 130.2 secs
Computing kpt #: 257
total cpu time spent up to now is 130.7 secs
Computing kpt #: 258
total cpu time spent up to now is 131.2 secs
Computing kpt #: 259
total cpu time spent up to now is 131.7 secs
Computing kpt #: 260
total cpu time spent up to now is 132.2 secs
Computing kpt #: 261
total cpu time spent up to now is 132.7 secs
Computing kpt #: 262
total cpu time spent up to now is 133.1 secs
Computing kpt #: 263
total cpu time spent up to now is 133.6 secs
Computing kpt #: 264
total cpu time spent up to now is 134.0 secs
Computing kpt #: 265
total cpu time spent up to now is 134.5 secs
Computing kpt #: 266
total cpu time spent up to now is 134.9 secs
Computing kpt #: 267
total cpu time spent up to now is 135.3 secs
Computing kpt #: 268
total cpu time spent up to now is 135.8 secs
Computing kpt #: 269
total cpu time spent up to now is 136.2 secs
Computing kpt #: 270
total cpu time spent up to now is 136.7 secs
Computing kpt #: 271
total cpu time spent up to now is 137.1 secs
Computing kpt #: 272
total cpu time spent up to now is 137.6 secs
Computing kpt #: 273
total cpu time spent up to now is 138.1 secs
Computing kpt #: 274
total cpu time spent up to now is 138.6 secs
Computing kpt #: 275
total cpu time spent up to now is 139.1 secs
Computing kpt #: 276
total cpu time spent up to now is 139.6 secs
Computing kpt #: 277
total cpu time spent up to now is 140.1 secs
Computing kpt #: 278
total cpu time spent up to now is 140.6 secs
Computing kpt #: 279
total cpu time spent up to now is 141.1 secs
Computing kpt #: 280
total cpu time spent up to now is 141.7 secs
Computing kpt #: 281
total cpu time spent up to now is 142.2 secs
Computing kpt #: 282
total cpu time spent up to now is 142.7 secs
Computing kpt #: 283
total cpu time spent up to now is 143.2 secs
Computing kpt #: 284
total cpu time spent up to now is 143.7 secs
Computing kpt #: 285
total cpu time spent up to now is 144.2 secs
Computing kpt #: 286
total cpu time spent up to now is 144.7 secs
Computing kpt #: 287
total cpu time spent up to now is 145.2 secs
Computing kpt #: 288
total cpu time spent up to now is 145.7 secs
Computing kpt #: 289
total cpu time spent up to now is 146.1 secs
Computing kpt #: 290
total cpu time spent up to now is 146.6 secs
Computing kpt #: 291
total cpu time spent up to now is 147.1 secs
Computing kpt #: 292
total cpu time spent up to now is 147.6 secs
Computing kpt #: 293
total cpu time spent up to now is 148.1 secs
Computing kpt #: 294
total cpu time spent up to now is 148.6 secs
Computing kpt #: 295
total cpu time spent up to now is 149.2 secs
Computing kpt #: 296
total cpu time spent up to now is 149.7 secs
Computing kpt #: 297
total cpu time spent up to now is 150.2 secs
Computing kpt #: 298
total cpu time spent up to now is 150.7 secs
Computing kpt #: 299
total cpu time spent up to now is 151.3 secs
Computing kpt #: 300
total cpu time spent up to now is 151.9 secs
Computing kpt #: 301
total cpu time spent up to now is 152.5 secs
Computing kpt #: 302
total cpu time spent up to now is 153.1 secs
Computing kpt #: 303
total cpu time spent up to now is 153.7 secs
Computing kpt #: 304
total cpu time spent up to now is 154.3 secs
Computing kpt #: 305
total cpu time spent up to now is 154.9 secs
Computing kpt #: 306
total cpu time spent up to now is 155.5 secs
Computing kpt #: 307
total cpu time spent up to now is 156.1 secs
Computing kpt #: 308
total cpu time spent up to now is 156.7 secs
Computing kpt #: 309
total cpu time spent up to now is 157.3 secs
Computing kpt #: 310
total cpu time spent up to now is 157.9 secs
Computing kpt #: 311
total cpu time spent up to now is 158.5 secs
Computing kpt #: 312
total cpu time spent up to now is 159.1 secs
Computing kpt #: 313
total cpu time spent up to now is 159.7 secs
Computing kpt #: 314
total cpu time spent up to now is 160.3 secs
ethr = 3.13E-08, avg # of iterations = 16.7
total cpu time spent up to now is 160.3 secs
End of band structure calculation
k = 0.0000 0.0000 0.0000 ( 9377 PWs) bands (ev):
-39.0582 -39.0582 -39.0396 -39.0396 -7.1332 -7.1332 -7.1332 -7.1332
-7.0434 -7.0434 -7.0434 -7.0434 -6.4286 -6.4286 -6.1918 -6.1918
-6.1918 -6.1918 -6.0819 -6.0819 -6.0819 -6.0819 -6.0075 -6.0075
-0.7736 -0.7736 8.8820 8.8820 9.1334 9.1334 9.3326 9.3326
9.3326 9.3326 9.3912 9.3912 9.6378 9.6378 9.6378 9.6378
k = 0.0106-0.0061 0.0087 ( 9377 PWs) bands (ev):
-39.0582 -39.0582 -39.0396 -39.0396 -7.1332 -7.1332 -7.1331 -7.1331
-7.0434 -7.0434 -7.0433 -7.0433 -6.4285 -6.4285 -6.1920 -6.1920
-6.1917 -6.1917 -6.0819 -6.0819 -6.0817 -6.0817 -6.0075 -6.0075
-0.7723 -0.7723 8.8408 8.8408 9.0922 9.0922 9.2279 9.2279
9.3779 9.3779 9.4703 9.4703 9.6628 9.6628 9.6767 9.6767
k = 0.0213-0.0123 0.0174 ( 9377 PWs) bands (ev):
-39.0582 -39.0582 -39.0396 -39.0396 -7.1332 -7.1332 -7.1331 -7.1331
-7.0436 -7.0436 -7.0432 -7.0432 -6.4281 -6.4281 -6.1927 -6.1927
-6.1917 -6.1917 -6.0818 -6.0818 -6.0813 -6.0813 -6.0076 -6.0076
-0.7682 -0.7682 8.7438 8.7438 8.9984 8.9984 9.0929 9.0929
9.4794 9.4794 9.5153 9.5153 9.7510 9.7510 9.7717 9.7717
k = 0.0319-0.0184 0.0261 ( 9373 PWs) bands (ev):
-39.0581 -39.0581 -39.0396 -39.0396 -7.1333 -7.1333 -7.1329 -7.1329
-7.0438 -7.0438 -7.0430 -7.0430 -6.4275 -6.4275 -6.1940 -6.1940
-6.1916 -6.1916 -6.0817 -6.0817 -6.0805 -6.0805 -6.0078 -6.0078
-0.7615 -0.7615 8.6230 8.6230 8.8829 8.8829 8.9558 8.9558
9.5195 9.5195 9.6032 9.6032 9.8809 9.8809 9.8934 9.8934
k = 0.0426-0.0246 0.0347 ( 9365 PWs) bands (ev):
-39.0581 -39.0581 -39.0396 -39.0396 -7.1333 -7.1333 -7.1327 -7.1327
-7.0442 -7.0442 -7.0426 -7.0426 -6.4265 -6.4265 -6.1956 -6.1956
-6.1915 -6.1915 -6.0816 -6.0816 -6.0794 -6.0794 -6.0081 -6.0081
-0.7521 -0.7521 8.4920 8.4920 8.7589 8.7589 8.8194 8.8194
9.5080 9.5080 9.7365 9.7365 10.0251 10.0251 10.0277 10.0277
k = 0.0532-0.0307 0.0434 ( 9353 PWs) bands (ev):
-39.0580 -39.0580 -39.0397 -39.0397 -7.1334 -7.1334 -7.1325 -7.1325
-7.0446 -7.0446 -7.0422 -7.0422 -6.4254 -6.4254 -6.1977 -6.1977
-6.1914 -6.1914 -6.0814 -6.0814 -6.0781 -6.0781 -6.0084 -6.0084
-0.7400 -0.7400 8.3559 8.3559 8.6317 8.6317 8.6846 8.6846
9.4885 9.4885 9.8745 9.8745 10.1685 10.1685 10.1751 10.1751
k = 0.0638-0.0369 0.0521 ( 9345 PWs) bands (ev):
-39.0580 -39.0580 -39.0397 -39.0397 -7.1336 -7.1336 -7.1322 -7.1322
-7.0452 -7.0452 -7.0417 -7.0417 -6.4239 -6.4239 -6.2001 -6.2001
-6.1913 -6.1913 -6.0811 -6.0811 -6.0766 -6.0766 -6.0088 -6.0088
-0.7252 -0.7252 8.2168 8.2168 8.5038 8.5038 8.5517 8.5517
9.4636 9.4636 10.0149 10.0149 10.3131 10.3131 10.3280 10.3280
k = 0.0745-0.0430 0.0608 ( 9349 PWs) bands (ev):
-39.0579 -39.0579 -39.0398 -39.0398 -7.1337 -7.1337 -7.1318 -7.1318
-7.0458 -7.0458 -7.0411 -7.0411 -6.4223 -6.4223 -6.2029 -6.2029
-6.1912 -6.1912 -6.0808 -6.0808 -6.0749 -6.0749 -6.0092 -6.0092
-0.7078 -0.7078 8.0755 8.0755 8.3766 8.3766 8.4211 8.4211
9.4345 9.4345 10.1562 10.1562 10.4598 10.4598 10.4826 10.4826
k = 0.0851-0.0491 0.0695 ( 9341 PWs) bands (ev):
-39.0578 -39.0578 -39.0399 -39.0399 -7.1338 -7.1338 -7.1314 -7.1314
-7.0465 -7.0465 -7.0405 -7.0405 -6.4204 -6.4204 -6.2060 -6.2060
-6.1911 -6.1911 -6.0804 -6.0804 -6.0732 -6.0732 -6.0097 -6.0097
-0.6876 -0.6876 7.9325 7.9325 8.2508 8.2508 8.2929 8.2929
9.4021 9.4021 10.2967 10.2967 10.6075 10.6075 10.6380 10.6380
k = 0.0957-0.0553 0.0782 ( 9341 PWs) bands (ev):
-39.0577 -39.0577 -39.0399 -39.0399 -7.1340 -7.1340 -7.1309 -7.1309
-7.0473 -7.0473 -7.0398 -7.0398 -6.4182 -6.4182 -6.2092 -6.2092
-6.1910 -6.1910 -6.0800 -6.0800 -6.0714 -6.0714 -6.0102 -6.0102
-0.6648 -0.6648 7.7879 7.7879 8.1268 8.1268 8.1672 8.1672
9.3669 9.3669 10.4336 10.4336 10.7554 10.7554 10.7935 10.7935
k = 0.1064-0.0614 0.0869 ( 9349 PWs) bands (ev):
-39.0576 -39.0576 -39.0400 -39.0400 -7.1342 -7.1342 -7.1304 -7.1304
-7.0481 -7.0481 -7.0390 -7.0390 -6.4158 -6.4158 -6.2127 -6.2127
-6.1909 -6.1909 -6.0794 -6.0794 -6.0696 -6.0696 -6.0107 -6.0107
-0.6392 -0.6392 7.6419 7.6419 8.0051 8.0051 8.0441 8.0441
9.3295 9.3295 10.5589 10.5589 10.9015 10.9015 10.9481 10.9481
k = 0.1170-0.0676 0.0955 ( 9349 PWs) bands (ev):
-39.0575 -39.0575 -39.0402 -39.0402 -7.1343 -7.1343 -7.1298 -7.1298
-7.0490 -7.0490 -7.0382 -7.0382 -6.4132 -6.4132 -6.2163 -6.2163
-6.1909 -6.1909 -6.0787 -6.0787 -6.0679 -6.0679 -6.0112 -6.0112
-0.6110 -0.6110 7.4944 7.4944 7.8859 7.8859 7.9237 7.9237
9.2904 9.2904 10.6436 10.6436 10.9640 10.9640 11.0556 11.0556
k = 0.1277-0.0737 0.1042 ( 9349 PWs) bands (ev):
-39.0574 -39.0574 -39.0403 -39.0403 -7.1345 -7.1345 -7.1292 -7.1292
-7.0500 -7.0500 -7.0373 -7.0373 -6.4104 -6.4104 -6.2201 -6.2201
-6.1910 -6.1910 -6.0779 -6.0779 -6.0664 -6.0664 -6.0116 -6.0116
-0.5801 -0.5801 7.3456 7.3456 7.7692 7.7692 7.8060 7.8060
9.2500 9.2500 10.6302 10.6302 10.9987 10.9987 11.1993 11.1993
k = 0.1383-0.0798 0.1129 ( 9365 PWs) bands (ev):
-39.0573 -39.0573 -39.0404 -39.0404 -7.1347 -7.1347 -7.1285 -7.1285
-7.0510 -7.0510 -7.0365 -7.0365 -6.4074 -6.4074 -6.2240 -6.2240
-6.1911 -6.1911 -6.0770 -6.0770 -6.0650 -6.0650 -6.0120 -6.0120
-0.5465 -0.5465 7.1955 7.1955 7.6554 7.6554 7.6911 7.6911
9.2087 9.2087 10.5436 10.5436 11.1044 11.1044 11.3444 11.3444
k = 0.1489-0.0860 0.1216 ( 9369 PWs) bands (ev):
-39.0572 -39.0572 -39.0405 -39.0405 -7.1348 -7.1348 -7.1278 -7.1278
-7.0521 -7.0521 -7.0356 -7.0356 -6.4042 -6.4042 -6.2279 -6.2279
-6.1912 -6.1912 -6.0760 -6.0760 -6.0638 -6.0638 -6.0122 -6.0122
-0.5102 -0.5102 7.0441 7.0441 7.5443 7.5443 7.5791 7.5791
9.1669 9.1669 10.4358 10.4358 11.2303 11.2303 11.4895 11.4895
k = 0.1596-0.0921 0.1303 ( 9349 PWs) bands (ev):
-39.0570 -39.0570 -39.0407 -39.0407 -7.1350 -7.1350 -7.1271 -7.1271
-7.0532 -7.0532 -7.0346 -7.0346 -6.4008 -6.4008 -6.2319 -6.2319
-6.1915 -6.1915 -6.0748 -6.0748 -6.0630 -6.0630 -6.0124 -6.0124
-0.4712 -0.4712 6.8916 6.8916 7.4361 7.4361 7.4700 7.4700
9.1249 9.1249 10.3234 10.3234 11.3592 11.3592 11.6355 11.6355
k = 0.1702-0.0983 0.1390 ( 9349 PWs) bands (ev):
-39.0569 -39.0569 -39.0408 -39.0408 -7.1351 -7.1351 -7.1263 -7.1263
-7.0543 -7.0543 -7.0337 -7.0337 -6.3972 -6.3972 -6.2358 -6.2358
-6.1918 -6.1918 -6.0735 -6.0735 -6.0624 -6.0624 -6.0123 -6.0123
-0.4296 -0.4296 6.7380 6.7380 7.3309 7.3309 7.3638 7.3638
9.0829 9.0829 10.2111 10.2111 11.4856 11.4856 11.7837 11.7837
k = 0.1809-0.1044 0.1477 ( 9337 PWs) bands (ev):
-39.0567 -39.0567 -39.0410 -39.0410 -7.1352 -7.1352 -7.1255 -7.1255
-7.0554 -7.0554 -7.0328 -7.0328 -6.3935 -6.3935 -6.2398 -6.2398
-6.1923 -6.1923 -6.0720 -6.0720 -6.0623 -6.0623 -6.0121 -6.0121
-0.3852 -0.3852 6.5834 6.5834 7.2286 7.2286 7.2605 7.2605
9.0411 9.0411 10.1010 10.1010 11.6070 11.6070 11.9127 11.9127
k = 0.1915-0.1106 0.1564 ( 9353 PWs) bands (ev):
-39.0565 -39.0565 -39.0412 -39.0412 -7.1353 -7.1353 -7.1247 -7.1247
-7.0565 -7.0565 -7.0320 -7.0320 -6.3896 -6.3896 -6.2437 -6.2437
-6.1928 -6.1928 -6.0703 -6.0703 -6.0625 -6.0625 -6.0117 -6.0117
-0.3382 -0.3382 6.4280 6.4280 7.1294 7.1294 7.1603 7.1603
8.9998 8.9998 9.9939 9.9939 11.7229 11.7229 12.0238 12.0238
k = 0.2021-0.1167 0.1650 ( 9353 PWs) bands (ev):
-39.0563 -39.0563 -39.0413 -39.0413 -7.1354 -7.1354 -7.1238 -7.1238
-7.0576 -7.0576 -7.0311 -7.0311 -6.3856 -6.3856 -6.2476 -6.2476
-6.1934 -6.1934 -6.0685 -6.0685 -6.0632 -6.0632 -6.0110 -6.0110
-0.2885 -0.2885 6.2719 6.2719 7.0333 7.0333 7.0631 7.0631
8.9592 8.9592 9.8903 9.8903 11.8335 11.8335 12.1291 12.1291
k = 0.2128-0.1228 0.1737 ( 9329 PWs) bands (ev):
-39.0561 -39.0561 -39.0415 -39.0415 -7.1355 -7.1355 -7.1230 -7.1230
-7.0587 -7.0587 -7.0303 -7.0303 -6.3815 -6.3815 -6.2514 -6.2514
-6.1941 -6.1941 -6.0666 -6.0666 -6.0642 -6.0642 -6.0102 -6.0102
-0.2361 -0.2361 6.1152 6.1152 6.9402 6.9402 6.9689 6.9689
8.9195 8.9195 9.7905 9.7905 11.9398 11.9398 12.2300 12.2300
k = 0.2234-0.1290 0.1824 ( 9337 PWs) bands (ev):
-39.0559 -39.0559 -39.0417 -39.0417 -7.1355 -7.1355 -7.1221 -7.1221
-7.0598 -7.0598 -7.0295 -7.0295 -6.3773 -6.3773 -6.2551 -6.2551
-6.1949 -6.1949 -6.0657 -6.0657 -6.0645 -6.0645 -6.0092 -6.0092
-0.1811 -0.1811 5.9581 5.9581 6.8502 6.8502 6.8779 6.8779
8.8806 8.8806 9.6947 9.6947 12.0429 12.0429 12.3278 12.3278
k = 0.2340-0.1351 0.1911 ( 9329 PWs) bands (ev):
-39.0557 -39.0557 -39.0419 -39.0419 -7.1356 -7.1356 -7.1213 -7.1213
-7.0608 -7.0608 -7.0288 -7.0288 -6.3729 -6.3729 -6.2588 -6.2588
-6.1958 -6.1958 -6.0675 -6.0675 -6.0623 -6.0623 -6.0081 -6.0081
-0.1233 -0.1233 5.8007 5.8007 6.7634 6.7634 6.7900 6.7900
8.8429 8.8429 9.6028 9.6028 12.1438 12.1438 12.4238 12.4238
k = 0.2447-0.1413 0.1998 ( 9301 PWs) bands (ev):
-39.0555 -39.0555 -39.0421 -39.0421 -7.1356 -7.1356 -7.1204 -7.1204
-7.0617 -7.0617 -7.0282 -7.0282 -6.3685 -6.3685 -6.2623 -6.2623
-6.1968 -6.1968 -6.0696 -6.0696 -6.0599 -6.0599 -6.0069 -6.0069
-0.0629 -0.0629 5.6432 5.6432 6.6798 6.6798 6.7053 6.7053
8.8064 8.8064 9.5150 9.5150 12.2436 12.2436 12.5191 12.5191
k = 0.2553-0.1474 0.2085 ( 9301 PWs) bands (ev):
-39.0553 -39.0553 -39.0423 -39.0423 -7.1355 -7.1355 -7.1197 -7.1197
-7.0625 -7.0625 -7.0276 -7.0276 -6.3641 -6.3641 -6.2656 -6.2656
-6.1978 -6.1978 -6.0721 -6.0721 -6.0574 -6.0574 -6.0056 -6.0056
0.0002 0.0002 5.4857 5.4857 6.5994 6.5994 6.6237 6.6237
8.7711 8.7711 9.4313 9.4313 12.3429 12.3429 12.6143 12.6143
k = 0.2660-0.1536 0.2172 ( 9333 PWs) bands (ev):
-39.0551 -39.0551 -39.0426 -39.0426 -7.1354 -7.1354 -7.1189 -7.1189
-7.0633 -7.0633 -7.0271 -7.0271 -6.3595 -6.3595 -6.2689 -6.2689
-6.1988 -6.1988 -6.0749 -6.0749 -6.0548 -6.0548 -6.0042 -6.0042
0.0659 0.0659 5.3284 5.3284 6.5221 6.5221 6.5454 6.5454
8.7373 8.7373 9.3515 9.3515 12.4424 12.4424 12.7103 12.7103
k = 0.2766-0.1597 0.2258 ( 9349 PWs) bands (ev):
-39.0548 -39.0548 -39.0428 -39.0428 -7.1354 -7.1354 -7.1182 -7.1182
-7.0639 -7.0639 -7.0267 -7.0267 -6.3550 -6.3550 -6.2720 -6.2720
-6.1998 -6.1998 -6.0780 -6.0780 -6.0521 -6.0521 -6.0029 -6.0029
0.1344 0.1344 5.1715 5.1715 6.4482 6.4482 6.4703 6.4703
8.7049 8.7049 9.2757 9.2757 12.5427 12.5427 12.8074 12.8074
k = 0.2872-0.1658 0.2345 ( 9357 PWs) bands (ev):
-39.0546 -39.0546 -39.0431 -39.0431 -7.1352 -7.1352 -7.1176 -7.1176
-7.0643 -7.0643 -7.0264 -7.0264 -6.3505 -6.3505 -6.2749 -6.2749
-6.2009 -6.2009 -6.0813 -6.0813 -6.0493 -6.0493 -6.0015 -6.0015
0.2054 0.2054 5.0151 5.0151 6.3775 6.3775 6.3985 6.3985
8.6741 8.6741 9.2038 9.2038 12.6441 12.6441 12.9060 12.9060
k = 0.2979-0.1720 0.2432 ( 9337 PWs) bands (ev):
-39.0543 -39.0543 -39.0433 -39.0433 -7.1351 -7.1351 -7.1171 -7.1171
-7.0647 -7.0647 -7.0262 -7.0262 -6.3460 -6.3460 -6.2776 -6.2776
-6.2019 -6.2019 -6.0848 -6.0848 -6.0464 -6.0464 -6.0002 -6.0002
0.2792 0.2792 4.8594 4.8594 6.3101 6.3101 6.3300 6.3300
8.6448 8.6448 9.1356 9.1356 12.7470 12.7470 13.0065 13.0065
k = 0.3085-0.1781 0.2519 ( 9337 PWs) bands (ev):
-39.0541 -39.0541 -39.0435 -39.0435 -7.1349 -7.1349 -7.1167 -7.1167
-7.0648 -7.0648 -7.0261 -7.0261 -6.3415 -6.3415 -6.2802 -6.2802
-6.2028 -6.2028 -6.0886 -6.0886 -6.0435 -6.0435 -5.9989 -5.9989
0.3555 0.3555 4.7044 4.7044 6.2460 6.2460 6.2649 6.2649
8.6172 8.6172 9.0712 9.0712 12.8516 12.8516 13.1089 13.1089
k = 0.3191-0.1843 0.2606 ( 9341 PWs) bands (ev):
-39.0538 -39.0538 -39.0438 -39.0438 -7.1346 -7.1346 -7.1164 -7.1164
-7.0648 -7.0648 -7.0262 -7.0262 -6.3371 -6.3371 -6.2826 -6.2826
-6.2036 -6.2036 -6.0925 -6.0925 -6.0406 -6.0406 -5.9977 -5.9977
0.4345 0.4345 4.5503 4.5503 6.1853 6.1853 6.2031 6.2031
8.5913 8.5913 9.0103 9.0103 12.9580 12.9580 13.2136 13.2136
k = 0.3298-0.1904 0.2693 ( 9341 PWs) bands (ev):
-39.0535 -39.0535 -39.0441 -39.0441 -7.1343 -7.1343 -7.1162 -7.1162
-7.0646 -7.0646 -7.0263 -7.0263 -6.3329 -6.3329 -6.2848 -6.2848
-6.2043 -6.2043 -6.0967 -6.0967 -6.0376 -6.0376 -5.9966 -5.9966
0.5162 0.5162 4.3973 4.3973 6.1279 6.1279 6.1446 6.1446
8.5671 8.5671 8.9530 8.9530 13.0665 13.0665 13.3206 13.3206
k = 0.3404-0.1965 0.2780 ( 9341 PWs) bands (ev):
-39.0533 -39.0533 -39.0443 -39.0443 -7.1340 -7.1340 -7.1162 -7.1162
-7.0642 -7.0642 -7.0266 -7.0266 -6.3287 -6.3287 -6.2868 -6.2868
-6.2048 -6.2048 -6.1009 -6.1009 -6.0346 -6.0346 -5.9956 -5.9956
0.6005 0.6005 4.2455 4.2455 6.0740 6.0740 6.0896 6.0896
8.5448 8.5448 8.8991 8.8991 13.1772 13.1772 13.4300 13.4300
k = 0.3511-0.2027 0.2866 ( 9341 PWs) bands (ev):
-39.0530 -39.0530 -39.0446 -39.0446 -7.1337 -7.1337 -7.1162 -7.1162
-7.0636 -7.0636 -7.0269 -7.0269 -6.3248 -6.3248 -6.2887 -6.2887
-6.2052 -6.2052 -6.1053 -6.1053 -6.0317 -6.0317 -5.9948 -5.9948
0.6873 0.6873 4.0949 4.0949 6.0234 6.0234 6.0379 6.0379
8.5243 8.5243 8.8486 8.8486 13.2901 13.2901 13.5418 13.5418
k = 0.3617-0.2088 0.2953 ( 9337 PWs) bands (ev):
-39.0527 -39.0527 -39.0449 -39.0449 -7.1333 -7.1333 -7.1164 -7.1164
-7.0629 -7.0629 -7.0274 -7.0274 -6.3210 -6.3210 -6.2903 -6.2903
-6.2052 -6.2052 -6.1099 -6.1099 -6.0287 -6.0287 -5.9940 -5.9940
0.7768 0.7768 3.9457 3.9457 5.9763 5.9763 5.9897 5.9897
8.5056 8.5056 8.8013 8.8013 13.4054 13.4054 13.6562 13.6562
k = 0.3723-0.2150 0.3040 ( 9328 PWs) bands (ev):
-39.0524 -39.0524 -39.0452 -39.0452 -7.1329 -7.1329 -7.1167 -7.1167
-7.0620 -7.0620 -7.0281 -7.0281 -6.3176 -6.3176 -6.2918 -6.2918
-6.2050 -6.2050 -6.1146 -6.1146 -6.0258 -6.0258 -5.9934 -5.9934
0.8689 0.8689 3.7981 3.7981 5.9326 5.9326 5.9450 5.9450
8.4889 8.4889 8.7572 8.7572 13.5230 13.5230 13.7731 13.7731
k = 0.3830-0.2211 0.3127 ( 9328 PWs) bands (ev):
-39.0521 -39.0521 -39.0455 -39.0455 -7.1324 -7.1324 -7.1171 -7.1171
-7.0609 -7.0609 -7.0288 -7.0288 -6.3144 -6.3144 -6.2931 -6.2931
-6.2044 -6.2044 -6.1193 -6.1193 -6.0229 -6.0229 -5.9929 -5.9929
0.9636 0.9636 3.6519 3.6519 5.8924 5.8924 5.9037 5.9037
8.4741 8.4741 8.7162 8.7162 13.6431 13.6431 13.8926 13.8926
k = 0.3936-0.2273 0.3214 ( 9324 PWs) bands (ev):
-39.0518 -39.0518 -39.0457 -39.0457 -7.1319 -7.1319 -7.1176 -7.1176
-7.0597 -7.0597 -7.0296 -7.0296 -6.3115 -6.3115 -6.2942 -6.2942
-6.2034 -6.2034 -6.1242 -6.1242 -6.0201 -6.0201 -5.9926 -5.9926
1.0608 1.0608 3.5075 3.5075 5.8557 5.8557 5.8659 5.8659
8.4613 8.4613 8.6782 8.6782 13.7655 13.7655 14.0147 14.0147
k = 0.4043-0.2334 0.3301 ( 9324 PWs) bands (ev):
-39.0515 -39.0515 -39.0460 -39.0460 -7.1314 -7.1314 -7.1182 -7.1182
-7.0583 -7.0583 -7.0306 -7.0306 -6.3089 -6.3089 -6.2951 -6.2951
-6.2021 -6.2021 -6.1291 -6.1291 -6.0174 -6.0174 -5.9924 -5.9924
1.1606 1.1606 3.3648 3.3648 5.8224 5.8224 5.8317 5.8317
8.4505 8.4505 8.6431 8.6431 13.8904 13.8904 14.1393 14.1393
k = 0.4149-0.2395 0.3388 ( 9312 PWs) bands (ev):
-39.0512 -39.0512 -39.0463 -39.0463 -7.1308 -7.1308 -7.1188 -7.1188
-7.0569 -7.0569 -7.0317 -7.0317 -6.3066 -6.3066 -6.2959 -6.2959
-6.2004 -6.2004 -6.1341 -6.1341 -6.0148 -6.0148 -5.9924 -5.9924
1.2629 1.2629 3.2239 3.2239 5.7927 5.7927 5.8009 5.8009
8.4417 8.4417 8.6109 8.6109 14.0177 14.0177 14.2665 14.2665
k = 0.4255-0.2457 0.3474 ( 9324 PWs) bands (ev):
-39.0509 -39.0509 -39.0466 -39.0466 -7.1302 -7.1302 -7.1195 -7.1195
-7.0553 -7.0553 -7.0329 -7.0329 -6.3048 -6.3048 -6.2965 -6.2965
-6.1982 -6.1982 -6.1391 -6.1391 -6.0123 -6.0123 -5.9925 -5.9925
1.3677 1.3677 3.0850 3.0850 5.7665 5.7665 5.7737 5.7737
8.4351 8.4351 8.5816 8.5816 14.1474 14.1474 14.3962 14.3962
k = 0.4362-0.2518 0.3561 ( 9324 PWs) bands (ev):
-39.0506 -39.0506 -39.0469 -39.0469 -7.1295 -7.1295 -7.1203 -7.1203
-7.0537 -7.0537 -7.0341 -7.0341 -6.3032 -6.3032 -6.2971 -6.2971
-6.1956 -6.1956 -6.1441 -6.1441 -6.0099 -6.0099 -5.9929 -5.9929
1.4751 1.4751 2.9479 2.9479 5.7439 5.7439 5.7500 5.7500
8.4305 8.4305 8.5550 8.5550 14.2794 14.2794 14.5282 14.5282
k = 0.4468-0.2580 0.3648 ( 9336 PWs) bands (ev):
-39.0503 -39.0503 -39.0472 -39.0472 -7.1289 -7.1289 -7.1211 -7.1211
-7.0520 -7.0520 -7.0355 -7.0355 -6.3019 -6.3019 -6.2975 -6.2975
-6.1927 -6.1927 -6.1491 -6.1491 -6.0076 -6.0076 -5.9934 -5.9934
1.5849 1.5849 2.8130 2.8130 5.7247 5.7247 5.7299 5.7299
8.4281 8.4281 8.5310 8.5310 14.4137 14.4137 14.6624 14.6624
k = 0.4574-0.2641 0.3735 ( 9332 PWs) bands (ev):
-39.0500 -39.0500 -39.0476 -39.0476 -7.1282 -7.1282 -7.1218 -7.1218
-7.0503 -7.0503 -7.0369 -7.0369 -6.3009 -6.3009 -6.2978 -6.2978
-6.1894 -6.1894 -6.1541 -6.1541 -6.0055 -6.0055 -5.9940 -5.9940
1.6971 1.6971 2.6800 2.6800 5.7092 5.7092 5.7133 5.7133
8.4279 8.4279 8.5097 8.5097 14.5501 14.5501 14.7984 14.7984
k = 0.4681-0.2702 0.3822 ( 9336 PWs) bands (ev):
-39.0497 -39.0497 -39.0479 -39.0479 -7.1274 -7.1274 -7.1227 -7.1227
-7.0486 -7.0486 -7.0385 -7.0385 -6.3001 -6.3001 -6.2981 -6.2981
-6.1857 -6.1857 -6.1590 -6.1590 -6.0035 -6.0035 -5.9949 -5.9949
1.8118 1.8118 2.5493 2.5493 5.6972 5.6972 5.7003 5.7003
8.4300 8.4300 8.4910 8.4910 14.6884 14.6884 14.9352 14.9352
k = 0.4787-0.2764 0.3909 ( 9336 PWs) bands (ev):
-39.0494 -39.0494 -39.0482 -39.0482 -7.1267 -7.1267 -7.1235 -7.1235
-7.0469 -7.0469 -7.0401 -7.0401 -6.2995 -6.2995 -6.2983 -6.2983
-6.1818 -6.1818 -6.1639 -6.1639 -6.0017 -6.0017 -5.9959 -5.9959
1.9289 1.9289 2.4207 2.4207 5.6888 5.6888 5.6908 5.6908
8.4343 8.4343 8.4748 8.4748 14.8280 14.8280 15.0686 15.0686
k = 0.4894-0.2825 0.3996 ( 9352 PWs) bands (ev):
-39.0491 -39.0491 -39.0485 -39.0485 -7.1259 -7.1259 -7.1243 -7.1243
-7.0451 -7.0451 -7.0417 -7.0417 -6.2991 -6.2991 -6.2985 -6.2985
-6.1776 -6.1776 -6.1686 -6.1686 -6.0000 -6.0000 -5.9971 -5.9971
2.0484 2.0484 2.2943 2.2943 5.6839 5.6839 5.6849 5.6849
8.4408 8.4408 8.4611 8.4611 14.9674 14.9674 15.1652 15.1652
k = 0.5000-0.2887 0.4082 ( 9336 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1251 -7.1251 -7.1251 -7.1251
-7.0434 -7.0434 -7.0434 -7.0434 -6.2988 -6.2988 -6.2988 -6.2988
-6.1732 -6.1732 -6.1732 -6.1732 -5.9985 -5.9985 -5.9985 -5.9985
2.1702 2.1702 2.1702 2.1702 5.6826 5.6826 5.6826 5.6826
8.4498 8.4498 8.4498 8.4498 15.0999 15.0999 15.0999 15.0999
k = 0.5000-0.2887 0.4082 ( 9336 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1251 -7.1251 -7.1251 -7.1251
-7.0434 -7.0434 -7.0434 -7.0434 -6.2988 -6.2988 -6.2988 -6.2988
-6.1732 -6.1732 -6.1732 -6.1732 -5.9985 -5.9985 -5.9985 -5.9985
2.1702 2.1702 2.1702 2.1702 5.6826 5.6826 5.6826 5.6826
8.4498 8.4498 8.4498 8.4498 15.0999 15.0999 15.0999 15.0999
k = 0.5000-0.2766 0.4168 ( 9352 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1257 -7.1257 -7.1246 -7.1246
-7.0449 -7.0449 -7.0418 -7.0418 -6.3012 -6.3012 -6.2963 -6.2963
-6.1747 -6.1747 -6.1717 -6.1717 -6.0014 -6.0014 -5.9955 -5.9955
2.1692 2.1692 2.1718 2.1718 5.6753 5.6753 5.6840 5.6840
8.4531 8.4531 8.4588 8.4588 15.0837 15.0837 15.0938 15.0938
k = 0.5000-0.2646 0.4253 ( 9348 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1264 -7.1264 -7.1241 -7.1241
-7.0464 -7.0464 -7.0401 -7.0401 -6.3035 -6.3035 -6.2937 -6.2937
-6.1764 -6.1764 -6.1704 -6.1704 -6.0043 -6.0043 -5.9926 -5.9926
2.1690 2.1690 2.1741 2.1741 5.6623 5.6623 5.6795 5.6795
8.4688 8.4688 8.4802 8.4802 15.0418 15.0418 15.0610 15.0610
k = 0.5000-0.2526 0.4338 ( 9340 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1271 -7.1271 -7.1237 -7.1237
-7.0477 -7.0477 -7.0383 -7.0383 -6.3058 -6.3058 -6.2911 -6.2911
-6.1781 -6.1781 -6.1693 -6.1693 -6.0071 -6.0071 -5.9897 -5.9897
2.1693 2.1693 2.1770 2.1770 5.6439 5.6439 5.6693 5.6693
8.4967 8.4967 8.5134 8.5134 14.9673 14.9673 14.9926 14.9926
k = 0.5000-0.2406 0.4423 ( 9340 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1278 -7.1278 -7.1234 -7.1234
-7.0490 -7.0490 -7.0365 -7.0365 -6.3080 -6.3080 -6.2883 -6.2883
-6.1799 -6.1799 -6.1683 -6.1683 -6.0099 -6.0099 -5.9868 -5.9868
2.1703 2.1703 2.1805 2.1805 5.6206 5.6206 5.6539 5.6539
8.5363 8.5363 8.5580 8.5580 14.8586 14.8586 14.8861 14.8861
k = 0.5000-0.2285 0.4508 ( 9336 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1286 -7.1286 -7.1231 -7.1231
-7.0501 -7.0501 -7.0347 -7.0347 -6.3100 -6.3100 -6.2856 -6.2856
-6.1817 -6.1817 -6.1675 -6.1675 -6.0126 -6.0126 -5.9840 -5.9840
2.1719 2.1719 2.1846 2.1846 5.5931 5.5931 5.6339 5.6339
8.5870 8.5870 8.6134 8.6134 14.7216 14.7216 14.7494 14.7494
k = 0.5000-0.2165 0.4593 ( 9338 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1294 -7.1294 -7.1230 -7.1230
-7.0511 -7.0511 -7.0329 -7.0329 -6.3120 -6.3120 -6.2827 -6.2827
-6.1835 -6.1835 -6.1669 -6.1669 -6.0152 -6.0152 -5.9813 -5.9813
2.1741 2.1741 2.1893 2.1893 5.5621 5.5621 5.6098 5.6098
8.6482 8.6482 8.6788 8.6788 14.5645 14.5645 14.5920 14.5920
k = 0.5000-0.2045 0.4678 ( 9336 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1302 -7.1302 -7.1229 -7.1229
-7.0520 -7.0520 -7.0310 -7.0310 -6.3139 -6.3139 -6.2798 -6.2798
-6.1854 -6.1854 -6.1665 -6.1665 -6.0177 -6.0177 -5.9786 -5.9786
2.1768 2.1768 2.1944 2.1944 5.5283 5.5283 5.5824 5.5824
8.7191 8.7191 8.7534 8.7534 14.3938 14.3938 14.4210 14.4210
k = 0.5000-0.1925 0.4763 ( 9342 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1310 -7.1310 -7.1229 -7.1229
-7.0528 -7.0528 -7.0292 -7.0292 -6.3157 -6.3157 -6.2769 -6.2769
-6.1872 -6.1872 -6.1663 -6.1663 -6.0201 -6.0201 -5.9760 -5.9760
2.1799 2.1799 2.2000 2.2000 5.4924 5.4924 5.5525 5.5525
8.7990 8.7990 8.8366 8.8366 14.2144 14.2144 14.2413 14.2413
k = 0.5000-0.1804 0.4848 ( 9334 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1318 -7.1318 -7.1230 -7.1230
-7.0535 -7.0535 -7.0274 -7.0274 -6.3174 -6.3174 -6.2739 -6.2739
-6.1890 -6.1890 -6.1663 -6.1663 -6.0223 -6.0223 -5.9735 -5.9735
2.1835 2.1835 2.2059 2.2059 5.4553 5.4553 5.5209 5.5209
8.8871 8.8871 8.9276 8.9276 14.0295 14.0295 14.0562 14.0562
k = 0.5000-0.1684 0.4933 ( 9326 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1326 -7.1326 -7.1231 -7.1231
-7.0540 -7.0540 -7.0257 -7.0257 -6.3190 -6.3190 -6.2710 -6.2710
-6.1908 -6.1908 -6.1665 -6.1665 -6.0244 -6.0244 -5.9712 -5.9712
2.1873 2.1873 2.2121 2.2121 5.4175 5.4175 5.4881 5.4881
8.9825 8.9825 9.0256 9.0256 13.8415 13.8415 13.8680 13.8680
k = 0.5000-0.1564 0.5018 ( 9330 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1334 -7.1334 -7.1233 -7.1233
-7.0545 -7.0545 -7.0240 -7.0240 -6.3205 -6.3205 -6.2680 -6.2680
-6.1925 -6.1925 -6.1670 -6.1670 -6.0263 -6.0263 -5.9689 -5.9689
2.1915 2.1915 2.2184 2.2184 5.3798 5.3798 5.4549 5.4549
9.0846 9.0846 9.1299 9.1299 13.6521 13.6521 13.6785 13.6785
k = 0.5000-0.1443 0.5103 ( 9322 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1341 -7.1341 -7.1236 -7.1236
-7.0549 -7.0549 -7.0224 -7.0224 -6.3219 -6.3219 -6.2650 -6.2650
-6.1942 -6.1942 -6.1676 -6.1676 -6.0280 -6.0280 -5.9668 -5.9668
2.1958 2.1958 2.2249 2.2249 5.3426 5.3426 5.4219 5.4219
9.1926 9.1926 9.2399 9.2399 13.4626 13.4626 13.4888 13.4888
k = 0.5000-0.1323 0.5188 ( 9314 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1349 -7.1349 -7.1238 -7.1238
-7.0552 -7.0552 -7.0208 -7.0208 -6.3232 -6.3232 -6.2620 -6.2620
-6.1958 -6.1958 -6.1685 -6.1685 -6.0296 -6.0296 -5.9648 -5.9648
2.2002 2.2002 2.2314 2.2314 5.3066 5.3066 5.3896 5.3896
9.3057 9.3057 9.3548 9.3548 13.2743 13.2743 13.3002 13.3002
k = 0.5000-0.1203 0.5273 ( 9322 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1355 -7.1355 -7.1241 -7.1241
-7.0554 -7.0554 -7.0194 -7.0194 -6.3244 -6.3244 -6.2591 -6.2591
-6.1972 -6.1972 -6.1695 -6.1695 -6.0310 -6.0310 -5.9630 -5.9630
2.2046 2.2046 2.2378 2.2378 5.2721 5.2721 5.3585 5.3585
9.4232 9.4232 9.4739 9.4739 13.0879 13.0879 13.1136 13.1136
k = 0.5000-0.1083 0.5358 ( 9320 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1361 -7.1361 -7.1244 -7.1244
-7.0556 -7.0556 -7.0180 -7.0180 -6.3254 -6.3254 -6.2563 -6.2563
-6.1986 -6.1986 -6.1706 -6.1706 -6.0323 -6.0323 -5.9613 -5.9613
2.2089 2.2089 2.2439 2.2439 5.2397 5.2397 5.3292 5.3292
9.5441 9.5441 9.5964 9.5964 12.9047 12.9047 12.9299 12.9299
k = 0.5000-0.0962 0.5443 ( 9326 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1367 -7.1367 -7.1247 -7.1247
-7.0557 -7.0557 -7.0168 -7.0168 -6.3264 -6.3264 -6.2535 -6.2535
-6.1999 -6.1999 -6.1719 -6.1719 -6.0334 -6.0334 -5.9598 -5.9598
2.2130 2.2130 2.2498 2.2498 5.2096 5.2096 5.3019 5.3019
9.6674 9.6674 9.7214 9.7214 12.7256 12.7256 12.7501 12.7501
k = 0.5000-0.0842 0.5528 ( 9334 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1372 -7.1372 -7.1250 -7.1250
-7.0558 -7.0558 -7.0156 -7.0156 -6.3273 -6.3273 -6.2509 -6.2509
-6.2010 -6.2010 -6.1732 -6.1732 -6.0343 -6.0343 -5.9585 -5.9585
2.2170 2.2170 2.2553 2.2553 5.1823 5.1823 5.2770 5.2770
9.7919 9.7919 9.8476 9.8476 12.5519 12.5519 12.5756 12.5756
k = 0.5000-0.0722 0.5613 ( 9334 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1377 -7.1377 -7.1253 -7.1253
-7.0558 -7.0558 -7.0147 -7.0147 -6.3280 -6.3280 -6.2485 -6.2485
-6.2020 -6.2020 -6.1745 -6.1745 -6.0351 -6.0351 -5.9573 -5.9573
2.2205 2.2205 2.2602 2.2602 5.1581 5.1581 5.2548 5.2548
9.9159 9.9159 9.9734 9.9734 12.3854 12.3854 12.4079 12.4079
k = 0.5000-0.0601 0.5698 ( 9338 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1381 -7.1381 -7.1255 -7.1255
-7.0559 -7.0559 -7.0138 -7.0138 -6.3287 -6.3287 -6.2464 -6.2464
-6.2029 -6.2029 -6.1758 -6.1758 -6.0358 -6.0358 -5.9563 -5.9563
2.2237 2.2237 2.2646 2.2646 5.1371 5.1371 5.2356 5.2356
10.0370 10.0370 10.0966 10.0966 12.2283 12.2283 12.2492 12.2492
k = 0.5000-0.0481 0.5784 ( 9334 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1384 -7.1384 -7.1257 -7.1257
-7.0559 -7.0559 -7.0131 -7.0131 -6.3292 -6.3292 -6.2445 -6.2445
-6.2036 -6.2036 -6.1769 -6.1769 -6.0363 -6.0363 -5.9555 -5.9555
2.2264 2.2264 2.2683 2.2683 5.1197 5.1197 5.2197 5.2197
10.1519 10.1519 10.2138 10.2138 12.0840 12.0840 12.1031 12.1031
k = 0.5000-0.0361 0.5869 ( 9344 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1386 -7.1386 -7.1259 -7.1259
-7.0559 -7.0559 -7.0126 -7.0126 -6.3296 -6.3296 -6.2429 -6.2429
-6.2041 -6.2041 -6.1779 -6.1779 -6.0367 -6.0367 -5.9549 -5.9549
2.2285 2.2285 2.2713 2.2713 5.1059 5.1059 5.2070 5.2070
10.2553 10.2553 10.3199 10.3199 11.9577 11.9577 11.9744 11.9744
k = 0.5000-0.0241 0.5954 ( 9340 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1388 -7.1388 -7.1260 -7.1260
-7.0559 -7.0559 -7.0122 -7.0122 -6.3299 -6.3299 -6.2418 -6.2418
-6.2045 -6.2045 -6.1787 -6.1787 -6.0370 -6.0370 -5.9544 -5.9544
2.2301 2.2301 2.2734 2.2734 5.0960 5.0960 5.1979 5.1979
10.3402 10.3402 10.4076 10.4076 11.8565 11.8565 11.8707 11.8707
k = 0.5000-0.0120 0.6039 ( 9332 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1389 -7.1389 -7.1261 -7.1261
-7.0559 -7.0559 -7.0119 -7.0119 -6.3300 -6.3300 -6.2410 -6.2410
-6.2048 -6.2048 -6.1791 -6.1791 -6.0372 -6.0372 -5.9541 -5.9541
2.2311 2.2311 2.2747 2.2747 5.0900 5.0900 5.1924 5.1924
10.3972 10.3972 10.4669 10.4669 11.7897 11.7897 11.8017 11.8017
k = 0.5000-0.0000 0.6124 ( 9340 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1390 -7.1390 -7.1261 -7.1261
-7.0559 -7.0559 -7.0118 -7.0118 -6.3301 -6.3301 -6.2408 -6.2408
-6.2048 -6.2048 -6.1793 -6.1793 -6.0372 -6.0372 -5.9540 -5.9540
2.2314 2.2314 2.2752 2.2752 5.0880 5.0880 5.1906 5.1906
10.4175 10.4175 10.4881 10.4881 11.7661 11.7661 11.7773 11.7773
k = 0.5000-0.0000 0.6124 ( 9340 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1390 -7.1390 -7.1261 -7.1261
-7.0559 -7.0559 -7.0118 -7.0118 -6.3301 -6.3301 -6.2408 -6.2408
-6.2048 -6.2048 -6.1793 -6.1793 -6.0372 -6.0372 -5.9540 -5.9540
2.2314 2.2314 2.2752 2.2752 5.0880 5.0880 5.1906 5.1906
10.4175 10.4175 10.4881 10.4881 11.7661 11.7661 11.7773 11.7773
k = 0.4926 0.0127 0.6124 ( 9333 PWs) bands (ev):
-39.0489 -39.0489 -39.0486 -39.0486 -7.1390 -7.1390 -7.1261 -7.1261
-7.0559 -7.0559 -7.0119 -7.0119 -6.3301 -6.3301 -6.2410 -6.2410
-6.2049 -6.2049 -6.1791 -6.1791 -6.0372 -6.0372 -5.9541 -5.9541
2.1989 2.1989 2.3071 2.3071 5.0784 5.0784 5.2048 5.2048
10.3779 10.3779 10.5054 10.5054 11.7491 11.7491 11.8219 11.8219
k = 0.4853 0.0255 0.6124 ( 9336 PWs) bands (ev):
-39.0491 -39.0491 -39.0485 -39.0485 -7.1390 -7.1390 -7.1259 -7.1259
-7.0560 -7.0560 -7.0120 -7.0120 -6.3300 -6.3300 -6.2415 -6.2415
-6.2049 -6.2049 -6.1784 -6.1784 -6.0371 -6.0371 -5.9543 -5.9543
2.1543 2.1543 2.3498 2.3498 5.0562 5.0562 5.2407 5.2407
10.2850 10.2850 10.5353 10.5353 11.7675 11.7675 11.8821 11.8821
k = 0.4779 0.0382 0.6124 ( 9346 PWs) bands (ev):
-39.0492 -39.0492 -39.0484 -39.0484 -7.1391 -7.1391 -7.1256 -7.1256
-7.0562 -7.0562 -7.0121 -7.0121 -6.3299 -6.3299 -6.2422 -6.2422
-6.2050 -6.2050 -6.1774 -6.1774 -6.0370 -6.0370 -5.9547 -5.9547
2.1114 2.1114 2.3896 2.3896 5.0302 5.0302 5.2893 5.2893
10.1629 10.1629 10.5626 10.5626 11.8179 11.8179 11.9526 11.9526
k = 0.4706 0.0509 0.6124 ( 9340 PWs) bands (ev):
-39.0493 -39.0493 -39.0482 -39.0482 -7.1392 -7.1392 -7.1252 -7.1252
-7.0564 -7.0564 -7.0123 -7.0123 -6.3298 -6.3298 -6.2432 -6.2432
-6.2052 -6.2052 -6.1761 -6.1761 -6.0368 -6.0368 -5.9551 -5.9551
2.0711 2.0711 2.4254 2.4254 5.0038 5.0038 5.3465 5.3465
10.0233 10.0233 10.5852 10.5852 11.8919 11.8919 12.0327 12.0327
k = 0.4632 0.0637 0.6124 ( 9342 PWs) bands (ev):
-39.0495 -39.0495 -39.0481 -39.0481 -7.1393 -7.1393 -7.1246 -7.1246
-7.0567 -7.0567 -7.0125 -7.0125 -6.3297 -6.3297 -6.2443 -6.2443
-6.2053 -6.2053 -6.1747 -6.1747 -6.0366 -6.0366 -5.9557 -5.9557
2.0337 2.0337 2.4573 2.4573 4.9784 4.9784 5.4107 5.4107
9.8740 9.8740 10.6031 10.6031 11.9828 11.9828 12.1215 12.1215
k = 0.4559 0.0764 0.6124 ( 9346 PWs) bands (ev):
-39.0496 -39.0496 -39.0480 -39.0480 -7.1394 -7.1394 -7.1240 -7.1240
-7.0571 -7.0571 -7.0128 -7.0128 -6.3295 -6.3295 -6.2455 -6.2455
-6.2055 -6.2055 -6.1731 -6.1731 -6.0364 -6.0364 -5.9564 -5.9564
1.9992 1.9992 2.4854 2.4854 4.9544 4.9544 5.4805 5.4805
9.7204 9.7204 10.6169 10.6169 12.0858 12.0858 12.2179 12.2179
k = 0.4485 0.0891 0.6124 ( 9344 PWs) bands (ev):
-39.0497 -39.0497 -39.0479 -39.0479 -7.1395 -7.1395 -7.1234 -7.1234
-7.0575 -7.0575 -7.0131 -7.0131 -6.3293 -6.3293 -6.2467 -6.2467
-6.2057 -6.2057 -6.1715 -6.1715 -6.0361 -6.0361 -5.9571 -5.9571
1.9678 1.9678 2.5098 2.5098 4.9321 4.9321 5.5547 5.5547
9.5664 9.5664 10.6272 10.6272 12.1980 12.1980 12.3208 12.3208
k = 0.4412 0.1019 0.6124 ( 9330 PWs) bands (ev):
-39.0498 -39.0498 -39.0478 -39.0478 -7.1396 -7.1396 -7.1227 -7.1227
-7.0579 -7.0579 -7.0133 -7.0133 -6.3292 -6.3292 -6.2478 -6.2478
-6.2058 -6.2058 -6.1698 -6.1698 -6.0357 -6.0357 -5.9578 -5.9578
1.9393 1.9393 2.5308 2.5308 4.9118 4.9118 5.6319 5.6319
9.4150 9.4150 10.6347 10.6347 12.3171 12.3171 12.4292 12.4292
k = 0.4338 0.1146 0.6124 ( 9331 PWs) bands (ev):
-39.0498 -39.0498 -39.0477 -39.0477 -7.1398 -7.1398 -7.1220 -7.1220
-7.0584 -7.0584 -7.0136 -7.0136 -6.3290 -6.3290 -6.2490 -6.2490
-6.2060 -6.2060 -6.1683 -6.1683 -6.0354 -6.0354 -5.9586 -5.9586
1.9138 1.9138 2.5487 2.5487 4.8934 4.8934 5.7107 5.7107
9.2689 9.2689 10.6400 10.6400 12.4418 12.4418 12.5418 12.5418
k = 0.4265 0.1274 0.6124 ( 9327 PWs) bands (ev):
-39.0499 -39.0499 -39.0477 -39.0477 -7.1399 -7.1399 -7.1212 -7.1212
-7.0589 -7.0589 -7.0139 -7.0139 -6.3288 -6.3288 -6.2500 -6.2500
-6.2062 -6.2062 -6.1668 -6.1668 -6.0350 -6.0350 -5.9594 -5.9594
1.8914 1.8914 2.5638 2.5638 4.8770 4.8770 5.7895 5.7895
9.1302 9.1302 10.6436 10.6436 12.5708 12.5708 12.6575 12.6575
k = 0.4191 0.1401 0.6124 ( 9331 PWs) bands (ev):
-39.0500 -39.0500 -39.0476 -39.0476 -7.1400 -7.1400 -7.1206 -7.1206
-7.0593 -7.0593 -7.0141 -7.0141 -6.3287 -6.3287 -6.2509 -6.2509
-6.2063 -6.2063 -6.1655 -6.1655 -6.0347 -6.0347 -5.9601 -5.9601
1.8719 1.8719 2.5762 2.5762 4.8628 4.8628 5.8660 5.8660
9.0013 9.0013 10.6460 10.6460 12.7031 12.7031 12.7748 12.7748
k = 0.4118 0.1528 0.6124 ( 9328 PWs) bands (ev):
-39.0500 -39.0500 -39.0475 -39.0475 -7.1401 -7.1401 -7.1199 -7.1199
-7.0597 -7.0597 -7.0143 -7.0143 -6.3285 -6.3285 -6.2518 -6.2518
-6.2064 -6.2064 -6.1643 -6.1643 -6.0344 -6.0344 -5.9607 -5.9607
1.8554 1.8554 2.5863 2.5863 4.8507 4.8507 5.9381 5.9381
8.8849 8.8849 10.6475 10.6475 12.8374 12.8374 12.8923 12.8923
k = 0.4044 0.1656 0.6124 ( 9322 PWs) bands (ev):
-39.0501 -39.0501 -39.0475 -39.0475 -7.1402 -7.1402 -7.1194 -7.1194
-7.0601 -7.0601 -7.0145 -7.0145 -6.3284 -6.3284 -6.2525 -6.2525
-6.2065 -6.2065 -6.1633 -6.1633 -6.0341 -6.0341 -5.9613 -5.9613
1.8419 1.8419 2.5943 2.5943 4.8407 4.8407 6.0030 6.0030
8.7837 8.7837 10.6484 10.6484 12.9703 12.9703 13.0096 13.0096
k = 0.3971 0.1783 0.6124 ( 9317 PWs) bands (ev):
-39.0501 -39.0501 -39.0475 -39.0475 -7.1402 -7.1402 -7.1189 -7.1189
-7.0604 -7.0604 -7.0147 -7.0147 -6.3283 -6.3283 -6.2530 -6.2530
-6.2066 -6.2066 -6.1625 -6.1625 -6.0338 -6.0338 -5.9618 -5.9618
1.8315 1.8315 2.6003 2.6003 4.8329 4.8329 6.0579 6.0579
8.7006 8.7006 10.6489 10.6489 13.0899 13.0899 13.1325 13.1325
k = 0.3897 0.1910 0.6124 ( 9320 PWs) bands (ev):
-39.0501 -39.0501 -39.0474 -39.0474 -7.1403 -7.1403 -7.1186 -7.1186
-7.0607 -7.0607 -7.0148 -7.0148 -6.3282 -6.3282 -6.2534 -6.2534
-6.2067 -6.2067 -6.1620 -6.1620 -6.0337 -6.0337 -5.9622 -5.9622
1.8240 1.8240 2.6044 2.6044 4.8274 4.8274 6.0998 6.0998
8.6385 8.6385 10.6491 10.6491 13.1835 13.1835 13.2634 13.2634
k = 0.3824 0.2038 0.6124 ( 9326 PWs) bands (ev):
-39.0501 -39.0501 -39.0474 -39.0474 -7.1403 -7.1403 -7.1184 -7.1184
-7.0608 -7.0608 -7.0148 -7.0148 -6.3282 -6.3282 -6.2536 -6.2536
-6.2067 -6.2067 -6.1616 -6.1616 -6.0335 -6.0335 -5.9624 -5.9624
1.8195 1.8195 2.6069 2.6069 4.8241 4.8241 6.1262 6.1262
8.6000 8.6000 10.6492 10.6492 13.2465 13.2465 13.3860 13.3860
k = 0.3750 0.2165 0.6124 ( 9330 PWs) bands (ev):
-39.0501 -39.0501 -39.0474 -39.0474 -7.1403 -7.1403 -7.1183 -7.1183
-7.0609 -7.0609 -7.0149 -7.0149 -6.3282 -6.3282 -6.2537 -6.2537
-6.2067 -6.2067 -6.1615 -6.1615 -6.0335 -6.0335 -5.9625 -5.9625
1.8180 1.8180 2.6077 2.6077 4.8229 4.8229 6.1352 6.1352
8.5869 8.5869 10.6492 10.6492 13.2692 13.2692 13.4505 13.4505
k = 0.3750 0.2165 0.6124 ( 9330 PWs) bands (ev):
-39.0501 -39.0501 -39.0474 -39.0474 -7.1403 -7.1403 -7.1183 -7.1183
-7.0609 -7.0609 -7.0149 -7.0149 -6.3282 -6.3282 -6.2537 -6.2537
-6.2067 -6.2067 -6.1615 -6.1615 -6.0335 -6.0335 -5.9625 -5.9625
1.8180 1.8180 2.6077 2.6077 4.8229 4.8229 6.1352 6.1352
8.5869 8.5869 10.6492 10.6492 13.2692 13.2692 13.4505 13.4505
k = 0.3675 0.2122 0.6001 ( 9330 PWs) bands (ev):
-39.0503 -39.0503 -39.0473 -39.0473 -7.1411 -7.1411 -7.1178 -7.1178
-7.0617 -7.0617 -7.0138 -7.0138 -6.3291 -6.3291 -6.2526 -6.2526
-6.2076 -6.2076 -6.1611 -6.1611 -6.0342 -6.0342 -5.9620 -5.9620
1.7649 1.7649 2.6620 2.6620 4.7971 4.7971 6.1899 6.1899
8.6038 8.6038 10.8407 10.8407 13.1327 13.1327 13.3208 13.3208
k = 0.3600 0.2078 0.5879 ( 9320 PWs) bands (ev):
-39.0505 -39.0505 -39.0471 -39.0471 -7.1417 -7.1417 -7.1172 -7.1172
-7.0624 -7.0624 -7.0129 -7.0129 -6.3300 -6.3300 -6.2521 -6.2521
-6.2078 -6.2078 -6.1606 -6.1606 -6.0348 -6.0348 -5.9617 -5.9617
1.7078 1.7078 2.7196 2.7196 4.7788 4.7788 6.2476 6.2476
8.6216 8.6216 11.0311 11.0311 12.9976 12.9976 13.1927 13.1927
k = 0.3525 0.2035 0.5756 ( 9326 PWs) bands (ev):
-39.0506 -39.0506 -39.0469 -39.0469 -7.1423 -7.1423 -7.1166 -7.1166
-7.0632 -7.0632 -7.0122 -7.0122 -6.3307 -6.3307 -6.2522 -6.2522
-6.2076 -6.2076 -6.1600 -6.1600 -6.0353 -6.0353 -5.9618 -5.9618
1.6469 1.6469 2.7803 2.7803 4.7680 4.7680 6.3081 6.3081
8.6402 8.6402 11.2187 11.2187 12.8642 12.8642 13.0665 13.0665
k = 0.3450 0.1992 0.5634 ( 9316 PWs) bands (ev):
-39.0508 -39.0508 -39.0467 -39.0467 -7.1428 -7.1428 -7.1160 -7.1160
-7.0640 -7.0640 -7.0116 -7.0116 -6.3314 -6.3314 -6.2530 -6.2530
-6.2069 -6.2069 -6.1592 -6.1592 -6.0356 -6.0356 -5.9620 -5.9620
1.5827 1.5827 2.8444 2.8444 4.7648 4.7648 6.3715 6.3715
8.6597 8.6597 11.4012 11.4012 12.7327 12.7327 12.9423 12.9423
k = 0.3375 0.1949 0.5511 ( 9318 PWs) bands (ev):
-39.0510 -39.0510 -39.0466 -39.0466 -7.1432 -7.1432 -7.1154 -7.1154
-7.0647 -7.0647 -7.0112 -7.0112 -6.3321 -6.3321 -6.2542 -6.2542
-6.2058 -6.2058 -6.1582 -6.1582 -6.0359 -6.0359 -5.9626 -5.9626
1.5153 1.5153 2.9116 2.9116 4.7690 4.7690 6.4376 6.4376
8.6801 8.6801 11.5755 11.5755 12.6032 12.6032 12.8204 12.8204
k = 0.3300 0.1905 0.5389 ( 9318 PWs) bands (ev):
-39.0512 -39.0512 -39.0464 -39.0464 -7.1436 -7.1436 -7.1147 -7.1147
-7.0655 -7.0655 -7.0110 -7.0110 -6.3327 -6.3327 -6.2558 -6.2558
-6.2045 -6.2045 -6.1569 -6.1569 -6.0360 -6.0360 -5.9633 -5.9633
1.4452 1.4452 2.9822 2.9822 4.7803 4.7803 6.5066 6.5066
8.7013 8.7013 11.7377 11.7377 12.4759 12.4759 12.7011 12.7011
k = 0.3225 0.1862 0.5266 ( 9317 PWs) bands (ev):
-39.0514 -39.0514 -39.0462 -39.0462 -7.1439 -7.1439 -7.1140 -7.1140
-7.0663 -7.0663 -7.0108 -7.0108 -6.3332 -6.3332 -6.2577 -6.2577
-6.2032 -6.2032 -6.1552 -6.1552 -6.0361 -6.0361 -5.9644 -5.9644
1.3728 1.3728 3.0559 3.0559 4.7985 4.7985 6.5782 6.5782
8.7233 8.7233 11.8829 11.8829 12.3512 12.3512 12.5846 12.5846
k = 0.3150 0.1819 0.5144 ( 9317 PWs) bands (ev):
-39.0516 -39.0516 -39.0460 -39.0460 -7.1441 -7.1441 -7.1133 -7.1133
-7.0670 -7.0670 -7.0109 -7.0109 -6.3338 -6.3338 -6.2598 -6.2598
-6.2018 -6.2018 -6.1533 -6.1533 -6.0360 -6.0360 -5.9656 -5.9656
1.2984 1.2984 3.1330 3.1330 4.8233 4.8233 6.6524 6.6524
8.7460 8.7460 12.0047 12.0047 12.2301 12.2301 12.4717 12.4717
k = 0.3075 0.1775 0.5021 ( 9319 PWs) bands (ev):
-39.0518 -39.0518 -39.0458 -39.0458 -7.1443 -7.1443 -7.1126 -7.1126
-7.0677 -7.0677 -7.0110 -7.0110 -6.3344 -6.3344 -6.2619 -6.2619
-6.2006 -6.2006 -6.1510 -6.1510 -6.0360 -6.0360 -5.9671 -5.9671
1.2225 1.2225 3.2133 3.2133 4.8544 4.8544 6.7291 6.7291
8.7694 8.7694 12.0752 12.0752 12.1342 12.1342 12.3645 12.3645
k = 0.3000 0.1732 0.4899 ( 9313 PWs) bands (ev):
-39.0520 -39.0520 -39.0456 -39.0456 -7.1444 -7.1444 -7.1119 -7.1119
-7.0684 -7.0684 -7.0113 -7.0113 -6.3350 -6.3350 -6.2640 -6.2640
-6.1995 -6.1995 -6.1484 -6.1484 -6.0358 -6.0358 -5.9688 -5.9688
1.1454 1.1454 3.2969 3.2969 4.8916 4.8916 6.8084 6.8084
8.7935 8.7935 11.9821 11.9821 12.1604 12.1604 12.2756 12.2756
k = 0.2925 0.1689 0.4777 ( 9323 PWs) bands (ev):
-39.0522 -39.0522 -39.0454 -39.0454 -7.1444 -7.1444 -7.1112 -7.1112
-7.0691 -7.0691 -7.0117 -7.0117 -6.3357 -6.3357 -6.2660 -6.2660
-6.1986 -6.1986 -6.1454 -6.1454 -6.0356 -6.0356 -5.9707 -5.9707
1.0676 1.0676 3.3838 3.3838 4.9345 4.9345 6.8900 6.8900
8.8181 8.8181 11.8682 11.8682 12.1151 12.1151 12.2562 12.2562
k = 0.2850 0.1645 0.4654 ( 9323 PWs) bands (ev):
-39.0524 -39.0524 -39.0452 -39.0452 -7.1444 -7.1444 -7.1105 -7.1105
-7.0696 -7.0696 -7.0122 -7.0122 -6.3366 -6.3366 -6.2678 -6.2678
-6.1979 -6.1979 -6.1422 -6.1422 -6.0354 -6.0354 -5.9729 -5.9729
0.9892 0.9892 3.4740 3.4740 4.9830 4.9830 6.9739 6.9739
8.8433 8.8433 11.7554 11.7554 12.0223 12.0223 12.2624 12.2624
k = 0.2775 0.1602 0.4532 ( 9327 PWs) bands (ev):
-39.0526 -39.0526 -39.0449 -39.0449 -7.1444 -7.1444 -7.1099 -7.1099
-7.0701 -7.0701 -7.0129 -7.0129 -6.3376 -6.3376 -6.2695 -6.2695
-6.1974 -6.1974 -6.1387 -6.1387 -6.0352 -6.0352 -5.9752 -5.9752
0.9107 0.9107 3.5675 3.5675 5.0367 5.0367 7.0600 7.0600
8.8689 8.8689 11.6447 11.6447 11.9252 11.9252 12.2532 12.2532
k = 0.2700 0.1559 0.4409 ( 9327 PWs) bands (ev):
-39.0529 -39.0529 -39.0447 -39.0447 -7.1443 -7.1443 -7.1094 -7.1094
-7.0705 -7.0705 -7.0136 -7.0136 -6.3387 -6.3387 -6.2708 -6.2708
-6.1970 -6.1970 -6.1351 -6.1351 -6.0349 -6.0349 -5.9777 -5.9777
0.8324 0.8324 3.6642 3.6642 5.0954 5.0954 7.1481 7.1481
8.8949 8.8949 11.5366 11.5366 11.8296 11.8296 12.2254 12.2254
k = 0.2625 0.1516 0.4287 ( 9323 PWs) bands (ev):
-39.0531 -39.0531 -39.0445 -39.0445 -7.1442 -7.1442 -7.1090 -7.1090
-7.0708 -7.0708 -7.0144 -7.0144 -6.3401 -6.3401 -6.2717 -6.2717
-6.1968 -6.1968 -6.1313 -6.1313 -6.0347 -6.0347 -5.9803 -5.9803
0.7544 0.7544 3.7642 3.7642 5.1589 5.1589 7.2382 7.2382
8.9211 8.9211 11.4309 11.4309 11.7366 11.7366 12.1803 12.1803
k = 0.2550 0.1472 0.4164 ( 9333 PWs) bands (ev):
-39.0533 -39.0533 -39.0443 -39.0443 -7.1440 -7.1440 -7.1087 -7.1087
-7.0710 -7.0710 -7.0152 -7.0152 -6.3418 -6.3418 -6.2724 -6.2724
-6.1967 -6.1967 -6.1274 -6.1274 -6.0344 -6.0344 -5.9831 -5.9831
0.6771 0.6771 3.8675 3.8675 5.2270 5.2270 7.3301 7.3301
8.9475 8.9475 11.3279 11.3279 11.6467 11.6467 12.1234 12.1234
k = 0.2475 0.1429 0.4042 ( 9341 PWs) bands (ev):
-39.0535 -39.0535 -39.0441 -39.0441 -7.1439 -7.1439 -7.1086 -7.1086
-7.0710 -7.0710 -7.0162 -7.0162 -6.3437 -6.3437 -6.2726 -6.2726
-6.1966 -6.1966 -6.1235 -6.1235 -6.0342 -6.0342 -5.9860 -5.9860
0.6007 0.6007 3.9741 3.9741 5.2995 5.2995 7.4236 7.4236
8.9740 8.9740 11.2276 11.2276 11.5603 11.5603 12.0614 12.0614
k = 0.2400 0.1386 0.3919 ( 9339 PWs) bands (ev):
-39.0538 -39.0538 -39.0439 -39.0439 -7.1436 -7.1436 -7.1086 -7.1086
-7.0709 -7.0709 -7.0171 -7.0171 -6.3458 -6.3458 -6.2724 -6.2724
-6.1966 -6.1966 -6.1196 -6.1196 -6.0339 -6.0339 -5.9889 -5.9889
0.5253 0.5253 4.0840 4.0840 5.3762 5.3762 7.5185 7.5185
9.0005 9.0005 11.1300 11.1300 11.4776 11.4776 11.9989 11.9989
k = 0.2325 0.1342 0.3797 ( 9329 PWs) bands (ev):
-39.0540 -39.0540 -39.0436 -39.0436 -7.1434 -7.1434 -7.1087 -7.1087
-7.0705 -7.0705 -7.0182 -7.0182 -6.3482 -6.3482 -6.2718 -6.2718
-6.1966 -6.1966 -6.1157 -6.1157 -6.0338 -6.0338 -5.9920 -5.9920
0.4511 0.4511 4.1971 4.1971 5.4571 5.4571 7.6147 7.6147
9.0267 9.0267 11.0352 11.0352 11.3988 11.3988 11.9379 11.9379
k = 0.2250 0.1299 0.3674 ( 9333 PWs) bands (ev):
-39.0542 -39.0542 -39.0434 -39.0434 -7.1431 -7.1431 -7.1091 -7.1091
-7.0700 -7.0700 -7.0192 -7.0192 -6.3509 -6.3509 -6.2709 -6.2709
-6.1967 -6.1967 -6.1119 -6.1119 -6.0336 -6.0336 -5.9951 -5.9951
0.3784 0.3784 4.3135 4.3135 5.5418 5.5418 7.7119 7.7119
9.0527 9.0527 10.9431 10.9431 11.3241 11.3241 11.8792 11.8792
k = 0.2175 0.1256 0.3552 ( 9329 PWs) bands (ev):
-39.0544 -39.0544 -39.0432 -39.0432 -7.1428 -7.1428 -7.1096 -7.1096
-7.0694 -7.0694 -7.0203 -7.0203 -6.3537 -6.3537 -6.2695 -6.2695
-6.1968 -6.1968 -6.1082 -6.1082 -6.0336 -6.0336 -5.9981 -5.9981
0.3072 0.3072 4.4332 4.4332 5.6304 5.6304 7.8097 7.8097
9.0782 9.0782 10.8538 10.8538 11.2538 11.2538 11.8232 11.8232
k = 0.2100 0.1212 0.3429 ( 9331 PWs) bands (ev):
-39.0546 -39.0546 -39.0430 -39.0430 -7.1425 -7.1425 -7.1102 -7.1102
-7.0686 -7.0686 -7.0214 -7.0214 -6.3568 -6.3568 -6.2679 -6.2679
-6.1968 -6.1968 -6.1046 -6.1046 -6.0336 -6.0336 -6.0011 -6.0011
0.2376 0.2376 4.5561 4.5561 5.7227 5.7227 7.9080 7.9080
9.1032 9.1032 10.7674 10.7674 11.1882 11.1882 11.7698 11.7698
k = 0.2025 0.1169 0.3307 ( 9329 PWs) bands (ev):
-39.0548 -39.0548 -39.0428 -39.0428 -7.1422 -7.1422 -7.1110 -7.1110
-7.0676 -7.0676 -7.0225 -7.0225 -6.3600 -6.3600 -6.2659 -6.2659
-6.1969 -6.1969 -6.1012 -6.1012 -6.0338 -6.0338 -6.0041 -6.0041
0.1699 0.1699 4.6822 4.6822 5.8185 5.8185 8.0063 8.0063
9.1274 9.1274 10.6838 10.6838 11.1276 11.1276 11.7183 11.7183
k = 0.1950 0.1126 0.3184 ( 9329 PWs) bands (ev):
-39.0550 -39.0550 -39.0426 -39.0426 -7.1419 -7.1419 -7.1119 -7.1119
-7.0666 -7.0666 -7.0237 -7.0237 -6.3634 -6.3634 -6.2636 -6.2636
-6.1969 -6.1969 -6.0980 -6.0980 -6.0342 -6.0342 -6.0068 -6.0068
0.1040 0.1040 4.8115 4.8115 5.9178 5.9178 8.1042 8.1042
9.1507 9.1507 10.6031 10.6031 11.0722 11.0722 11.6678 11.6678
k = 0.1875 0.1083 0.3062 ( 9343 PWs) bands (ev):
-39.0553 -39.0553 -39.0424 -39.0424 -7.1415 -7.1415 -7.1129 -7.1129
-7.0655 -7.0655 -7.0248 -7.0248 -6.3668 -6.3668 -6.2611 -6.2611
-6.1969 -6.1969 -6.0950 -6.0950 -6.0348 -6.0348 -6.0092 -6.0092
0.0401 0.0401 4.9441 4.9441 6.0204 6.0204 8.2013 8.2013
9.1729 9.1729 10.5253 10.5253 11.0227 11.0227 11.6171 11.6171
k = 0.1800 0.1039 0.2939 ( 9325 PWs) bands (ev):
-39.0555 -39.0555 -39.0422 -39.0422 -7.1411 -7.1411 -7.1140 -7.1140
-7.0642 -7.0642 -7.0259 -7.0259 -6.3703 -6.3703 -6.2584 -6.2584
-6.1969 -6.1969 -6.0922 -6.0922 -6.0358 -6.0358 -6.0114 -6.0114
-0.0217 -0.0217 5.0798 5.0798 6.1263 6.1263 8.2968 8.2968
9.1941 9.1941 10.4504 10.4504 10.9794 10.9794 11.5648 11.5648
k = 0.1725 0.0996 0.2817 ( 9329 PWs) bands (ev):
-39.0557 -39.0557 -39.0420 -39.0420 -7.1407 -7.1407 -7.1151 -7.1151
-7.0630 -7.0630 -7.0271 -7.0271 -6.3739 -6.3739 -6.2554 -6.2554
-6.1968 -6.1968 -6.0897 -6.0897 -6.0371 -6.0371 -6.0131 -6.0131
-0.0814 -0.0814 5.2187 5.2187 6.2353 6.2353 8.3904 8.3904
9.2139 9.2139 10.3785 10.3785 10.9428 10.9428 11.5100 11.5100
k = 0.1650 0.0953 0.2694 ( 9337 PWs) bands (ev):
-39.0559 -39.0559 -39.0418 -39.0418 -7.1403 -7.1403 -7.1163 -7.1163
-7.0616 -7.0616 -7.0282 -7.0282 -6.3775 -6.3775 -6.2523 -6.2523
-6.1967 -6.1967 -6.0874 -6.0874 -6.0388 -6.0388 -6.0143 -6.0143
-0.1389 -0.1389 5.3607 5.3607 6.3474 6.3474 8.4811 8.4811
9.2323 9.2323 10.3096 10.3096 10.9137 10.9137 11.4526 11.4526
k = 0.1575 0.0909 0.2572 ( 9337 PWs) bands (ev):
-39.0560 -39.0560 -39.0416 -39.0416 -7.1399 -7.1399 -7.1175 -7.1175
-7.0603 -7.0603 -7.0293 -7.0293 -6.3812 -6.3812 -6.2490 -6.2490
-6.1966 -6.1966 -6.0854 -6.0854 -6.0409 -6.0409 -6.0152 -6.0152
-0.1941 -0.1941 5.5059 5.5059 6.4624 6.4624 8.5684 8.5684
9.2492 9.2492 10.2436 10.2436 10.8925 10.8925 11.3928 11.3928
k = 0.1500 0.0866 0.2449 ( 9333 PWs) bands (ev):
-39.0562 -39.0562 -39.0414 -39.0414 -7.1395 -7.1395 -7.1187 -7.1187
-7.0590 -7.0590 -7.0304 -7.0304 -6.3848 -6.3848 -6.2456 -6.2456
-6.1965 -6.1965 -6.0836 -6.0836 -6.0432 -6.0432 -6.0156 -6.0156
-0.2470 -0.2470 5.6542 5.6542 6.5803 6.5803 8.6513 8.6513
9.2646 9.2646 10.1807 10.1807 10.8799 10.8799 11.3311 11.3311
k = 0.1425 0.0823 0.2327 ( 9333 PWs) bands (ev):
-39.0564 -39.0564 -39.0413 -39.0413 -7.1391 -7.1391 -7.1200 -7.1200
-7.0576 -7.0576 -7.0314 -7.0314 -6.3884 -6.3884 -6.2421 -6.2421
-6.1963 -6.1963 -6.0821 -6.0821 -6.0458 -6.0458 -6.0157 -6.0157
-0.2975 -0.2975 5.8055 5.8055 6.7010 6.7010 8.7290 8.7290
9.2784 9.2784 10.1207 10.1207 10.8767 10.8767 11.2677 11.2677
k = 0.1350 0.0779 0.2205 ( 9343 PWs) bands (ev):
-39.0566 -39.0566 -39.0411 -39.0411 -7.1386 -7.1386 -7.1212 -7.1212
-7.0563 -7.0563 -7.0325 -7.0325 -6.3919 -6.3919 -6.2386 -6.2386
-6.1961 -6.1961 -6.0809 -6.0809 -6.0485 -6.0485 -6.0156 -6.0156
-0.3456 -0.3456 5.9599 5.9599 6.8244 6.8244 8.8009 8.8009
9.2905 9.2905 10.0638 10.0638 10.8833 10.8833 11.2026 11.2026
k = 0.1275 0.0736 0.2082 ( 9359 PWs) bands (ev):
-39.0567 -39.0567 -39.0409 -39.0409 -7.1382 -7.1382 -7.1224 -7.1224
-7.0551 -7.0551 -7.0335 -7.0335 -6.3953 -6.3953 -6.2349 -6.2349
-6.1958 -6.1958 -6.0800 -6.0800 -6.0513 -6.0513 -6.0153 -6.0153
-0.3913 -0.3913 6.1173 6.1173 6.9502 6.9502 8.8662 8.8662
9.3010 9.3010 10.0100 10.0100 10.9002 10.9002 11.1360 11.1360
k = 0.1200 0.0693 0.1960 ( 9371 PWs) bands (ev):
-39.0569 -39.0569 -39.0408 -39.0408 -7.1377 -7.1377 -7.1235 -7.1235
-7.0538 -7.0538 -7.0345 -7.0345 -6.3987 -6.3987 -6.2313 -6.2313
-6.1955 -6.1955 -6.0792 -6.0792 -6.0541 -6.0541 -6.0148 -6.0148
-0.4345 -0.4345 6.2777 6.2777 7.0786 7.0786 8.9244 8.9244
9.3100 9.3100 9.9592 9.9592 10.9275 10.9275 11.0675 11.0675
k = 0.1125 0.0650 0.1837 ( 9359 PWs) bands (ev):
-39.0570 -39.0570 -39.0406 -39.0406 -7.1373 -7.1373 -7.1246 -7.1246
-7.0526 -7.0526 -7.0354 -7.0354 -6.4020 -6.4020 -6.2276 -6.2276
-6.1952 -6.1952 -6.0787 -6.0787 -6.0569 -6.0569 -6.0143 -6.0143
-0.4753 -0.4753 6.4409 6.4409 7.2092 7.2092 8.9753 8.9753
9.3175 9.3175 9.9116 9.9116 10.9647 10.9647 10.9973 10.9973
k = 0.1050 0.0606 0.1715 ( 9349 PWs) bands (ev):
-39.0572 -39.0572 -39.0405 -39.0405 -7.1369 -7.1369 -7.1257 -7.1257
-7.0515 -7.0515 -7.0363 -7.0363 -6.4051 -6.4051 -6.2240 -6.2240
-6.1949 -6.1949 -6.0784 -6.0784 -6.0596 -6.0596 -6.0137 -6.0137
-0.5134 -0.5134 6.6070 6.6070 7.3420 7.3420 9.0188 9.0188
9.3235 9.3235 9.8670 9.8670 10.9230 10.9230 11.0136 11.0136
k = 0.0975 0.0563 0.1592 ( 9363 PWs) bands (ev):
-39.0573 -39.0573 -39.0404 -39.0404 -7.1364 -7.1364 -7.1266 -7.1266
-7.0504 -7.0504 -7.0372 -7.0372 -6.4081 -6.4081 -6.2204 -6.2204
-6.1946 -6.1946 -6.0783 -6.0783 -6.0623 -6.0623 -6.0130 -6.0130
-0.5491 -0.5491 6.7760 6.7760 7.4768 7.4768 9.0554 9.0554
9.3283 9.3283 9.8255 9.8255 10.8470 10.8470 11.0705 11.0705
k = 0.0900 0.0520 0.1470 ( 9367 PWs) bands (ev):
-39.0574 -39.0574 -39.0403 -39.0403 -7.1360 -7.1360 -7.1276 -7.1276
-7.0494 -7.0494 -7.0381 -7.0381 -6.4109 -6.4109 -6.2168 -6.2168
-6.1943 -6.1943 -6.0783 -6.0783 -6.0649 -6.0649 -6.0123 -6.0123
-0.5821 -0.5821 6.9476 6.9476 7.6134 7.6134 9.0854 9.0854
9.3319 9.3319 9.7871 9.7871 10.7673 10.7673 11.1355 11.1355
k = 0.0825 0.0476 0.1347 ( 9363 PWs) bands (ev):
-39.0576 -39.0576 -39.0401 -39.0401 -7.1356 -7.1356 -7.1285 -7.1285
-7.0485 -7.0485 -7.0388 -7.0388 -6.4136 -6.4136 -6.2134 -6.2134
-6.1940 -6.1940 -6.0785 -6.0785 -6.0673 -6.0673 -6.0117 -6.0117
-0.6126 -0.6126 7.1219 7.1219 7.7517 7.7517 9.1096 9.1096
9.3344 9.3344 9.7519 9.7519 10.6836 10.6836 11.2067 11.2067
k = 0.0750 0.0433 0.1225 ( 9359 PWs) bands (ev):
-39.0577 -39.0577 -39.0400 -39.0400 -7.1352 -7.1352 -7.1293 -7.1293
-7.0476 -7.0476 -7.0396 -7.0396 -6.4161 -6.4161 -6.2101 -6.2101
-6.1936 -6.1936 -6.0788 -6.0788 -6.0696 -6.0696 -6.0110 -6.0110
-0.6404 -0.6404 7.2986 7.2986 7.8913 7.8913 9.1287 9.1287
9.3361 9.3361 9.7197 9.7197 10.5954 10.5954 11.2772 11.2772
k = 0.0675 0.0390 0.1102 ( 9353 PWs) bands (ev):
-39.0578 -39.0578 -39.0399 -39.0399 -7.1349 -7.1349 -7.1300 -7.1300
-7.0468 -7.0468 -7.0403 -7.0403 -6.4184 -6.4184 -6.2070 -6.2070
-6.1933 -6.1933 -6.0791 -6.0791 -6.0718 -6.0718 -6.0104 -6.0104
-0.6657 -0.6657 7.4776 7.4776 8.0320 8.0320 9.1437 9.1437
9.3370 9.3370 9.6906 9.6906 10.5024 10.5024 11.1903 11.1903
k = 0.0600 0.0346 0.0980 ( 9357 PWs) bands (ev):
-39.0578 -39.0578 -39.0399 -39.0399 -7.1345 -7.1345 -7.1307 -7.1307
-7.0461 -7.0461 -7.0409 -7.0409 -6.4205 -6.4205 -6.2041 -6.2041
-6.1930 -6.1930 -6.0796 -6.0796 -6.0738 -6.0738 -6.0098 -6.0098
-0.6883 -0.6883 7.6587 7.6587 8.1735 8.1735 9.1553 9.1553
9.3372 9.3372 9.6646 9.6646 10.4043 10.4043 10.9927 10.9927
k = 0.0525 0.0303 0.0857 ( 9359 PWs) bands (ev):
-39.0579 -39.0579 -39.0398 -39.0398 -7.1342 -7.1342 -7.1312 -7.1312
-7.0455 -7.0455 -7.0415 -7.0415 -6.4224 -6.4224 -6.2014 -6.2014
-6.1928 -6.1928 -6.0800 -6.0800 -6.0756 -6.0756 -6.0093 -6.0093
-0.7083 -0.7083 7.8414 7.8414 8.3152 8.3152 9.1644 9.1644
9.3370 9.3370 9.6415 9.6415 10.3012 10.3012 10.7854 10.7854
k = 0.0450 0.0260 0.0735 ( 9353 PWs) bands (ev):
-39.0580 -39.0580 -39.0397 -39.0397 -7.1340 -7.1340 -7.1317 -7.1317
-7.0449 -7.0449 -7.0420 -7.0420 -6.4240 -6.4240 -6.1990 -6.1990
-6.1925 -6.1925 -6.0804 -6.0804 -6.0772 -6.0772 -6.0088 -6.0088
-0.7256 -0.7256 8.0251 8.0251 8.4565 8.4565 9.1719 9.1719
9.3365 9.3365 9.6212 9.6212 10.1934 10.1934 10.5761 10.5761
k = 0.0375 0.0217 0.0612 ( 9353 PWs) bands (ev):
-39.0580 -39.0580 -39.0397 -39.0397 -7.1337 -7.1337 -7.1322 -7.1322
-7.0444 -7.0444 -7.0424 -7.0424 -6.4254 -6.4254 -6.1969 -6.1969
-6.1923 -6.1923 -6.0808 -6.0808 -6.0786 -6.0786 -6.0084 -6.0084
-0.7402 -0.7402 8.2088 8.2088 8.5965 8.5965 9.1788 9.1788
9.3358 9.3358 9.6034 9.6034 10.0818 10.0818 10.3681 10.3681
k = 0.0300 0.0173 0.0490 ( 9357 PWs) bands (ev):
-39.0581 -39.0581 -39.0396 -39.0396 -7.1335 -7.1335 -7.1325 -7.1325
-7.0441 -7.0441 -7.0427 -7.0427 -6.4266 -6.4266 -6.1951 -6.1951
-6.1921 -6.1921 -6.0812 -6.0812 -6.0798 -6.0798 -6.0081 -6.0081
-0.7523 -0.7523 8.3903 8.3903 8.7338 8.7338 9.1866 9.1866
9.3349 9.3349 9.5873 9.5873 9.9680 9.9680 10.1642 10.1642
k = 0.0225 0.0130 0.0367 ( 9371 PWs) bands (ev):
-39.0581 -39.0581 -39.0396 -39.0396 -7.1334 -7.1334 -7.1328 -7.1328
-7.0438 -7.0438 -7.0430 -7.0430 -6.4275 -6.4275 -6.1936 -6.1936
-6.1920 -6.1920 -6.0815 -6.0815 -6.0807 -6.0807 -6.0078 -6.0078
-0.7616 -0.7616 8.5650 8.5650 8.8662 8.8662 9.1979 9.1979
9.3341 9.3341 9.5710 9.5710 9.8550 9.8550 9.9687 9.9687
k = 0.0150 0.0087 0.0245 ( 9377 PWs) bands (ev):
-39.0582 -39.0582 -39.0396 -39.0396 -7.1333 -7.1333 -7.1330 -7.1330
-7.0436 -7.0436 -7.0432 -7.0432 -6.4281 -6.4281 -6.1926 -6.1926
-6.1918 -6.1918 -6.0817 -6.0817 -6.0814 -6.0814 -6.0076 -6.0076
-0.7683 -0.7683 8.7222 8.7222 8.9892 8.9892 9.2189 9.2189
9.3334 9.3334 9.5462 9.5462 9.7487 9.7487 9.7936 9.7936
k = 0.0075 0.0043 0.0122 ( 9377 PWs) bands (ev):
-39.0582 -39.0582 -39.0396 -39.0396 -7.1332 -7.1332 -7.1331 -7.1331
-7.0434 -7.0434 -7.0433 -7.0433 -6.4285 -6.4285 -6.1920 -6.1920
-6.1918 -6.1918 -6.0819 -6.0819 -6.0818 -6.0818 -6.0075 -6.0075
-0.7723 -0.7723 8.8385 8.8385 9.0904 9.0904 9.2639 9.2639
9.3328 9.3328 9.4820 9.4820 9.6648 9.6648 9.6762 9.6762
k = 0.0000 0.0000 0.0000 ( 9377 PWs) bands (ev):
-39.0582 -39.0582 -39.0396 -39.0396 -7.1332 -7.1332 -7.1332 -7.1332
-7.0434 -7.0434 -7.0434 -7.0434 -6.4286 -6.4286 -6.1918 -6.1918
-6.1918 -6.1918 -6.0819 -6.0819 -6.0819 -6.0819 -6.0075 -6.0075
-0.7736 -0.7736 8.8820 8.8820 9.1334 9.1334 9.3326 9.3326
9.3326 9.3326 9.3912 9.3912 9.6378 9.6378 9.6378 9.6378
k = 0.0000 0.0000 0.0000 ( 9377 PWs) bands (ev):
-39.0582 -39.0582 -39.0396 -39.0396 -7.1332 -7.1332 -7.1332 -7.1332
-7.0434 -7.0434 -7.0434 -7.0434 -6.4286 -6.4286 -6.1918 -6.1918
-6.1918 -6.1918 -6.0819 -6.0819 -6.0819 -6.0819 -6.0075 -6.0075
-0.7736 -0.7736 8.8820 8.8820 9.1334 9.1334 9.3326 9.3326
9.3326 9.3326 9.3912 9.3912 9.6378 9.6378 9.6378 9.6378
k = 0.0122 0.0070 0.0050 ( 9377 PWs) bands (ev):
-39.0582 -39.0582 -39.0396 -39.0396 -7.1332 -7.1332 -7.1331 -7.1331
-7.0434 -7.0434 -7.0433 -7.0433 -6.4285 -6.4285 -6.1920 -6.1920
-6.1918 -6.1918 -6.0819 -6.0819 -6.0818 -6.0818 -6.0075 -6.0075
-0.7723 -0.7723 8.8379 8.8379 9.0915 9.0915 9.2824 9.2824
9.3114 9.3114 9.4849 9.4849 9.6606 9.6606 9.6798 9.6798
k = 0.0244 0.0141 0.0100 ( 9377 PWs) bands (ev):
-39.0582 -39.0582 -39.0396 -39.0396 -7.1333 -7.1333 -7.1330 -7.1330
-7.0435 -7.0435 -7.0432 -7.0432 -6.4281 -6.4281 -6.1925 -6.1925
-6.1919 -6.1919 -6.0817 -6.0817 -6.0814 -6.0814 -6.0076 -6.0076
-0.7683 -0.7683 8.7136 8.7136 9.0108 9.0108 9.2605 9.2605
9.2702 9.2702 9.5659 9.5659 9.7166 9.7166 9.8146 9.8146
k = 0.0366 0.0211 0.0149 ( 9363 PWs) bands (ev):
-39.0581 -39.0581 -39.0396 -39.0396 -7.1334 -7.1334 -7.1328 -7.1328
-7.0437 -7.0437 -7.0430 -7.0430 -6.4275 -6.4275 -6.1935 -6.1935
-6.1921 -6.1921 -6.0814 -6.0814 -6.0809 -6.0809 -6.0078 -6.0078
-0.7617 -0.7617 8.5402 8.5402 8.9354 8.9354 9.1966 9.1966
9.2702 9.2702 9.6268 9.6268 9.7887 9.7887 9.9998 9.9998
k = 0.0488 0.0282 0.0199 ( 9357 PWs) bands (ev):
-39.0581 -39.0581 -39.0396 -39.0396 -7.1336 -7.1336 -7.1325 -7.1325
-7.0440 -7.0440 -7.0428 -7.0428 -6.4266 -6.4266 -6.1948 -6.1948
-6.1923 -6.1923 -6.0809 -6.0809 -6.0801 -6.0801 -6.0081 -6.0081
-0.7524 -0.7524 8.3464 8.3464 8.8645 8.8645 9.1280 9.1280
9.2666 9.2666 9.6905 9.6905 9.8683 9.8683 10.1997 10.1997
k = 0.0610 0.0352 0.0249 ( 9363 PWs) bands (ev):
-39.0580 -39.0580 -39.0397 -39.0397 -7.1338 -7.1338 -7.1321 -7.1321
-7.0444 -7.0444 -7.0425 -7.0425 -6.4254 -6.4254 -6.1964 -6.1964
-6.1927 -6.1927 -6.0804 -6.0804 -6.0791 -6.0791 -6.0084 -6.0084
-0.7405 -0.7405 8.1449 8.1449 8.7953 8.7953 9.0582 9.0582
9.2573 9.2573 9.7597 9.7597 9.9516 9.9516 10.4033 10.4033
k = 0.0732 0.0422 0.0299 ( 9363 PWs) bands (ev):
-39.0580 -39.0580 -39.0397 -39.0397 -7.1340 -7.1340 -7.1317 -7.1317
-7.0448 -7.0448 -7.0421 -7.0421 -6.4240 -6.4240 -6.1984 -6.1984
-6.1931 -6.1931 -6.0797 -6.0797 -6.0779 -6.0779 -6.0088 -6.0088
-0.7260 -0.7260 7.9404 7.9404 8.7272 8.7272 8.9889 8.9889
9.2428 9.2428 9.8326 9.8326 10.0362 10.0362 10.6062 10.6062
k = 0.0854 0.0493 0.0349 ( 9369 PWs) bands (ev):
-39.0579 -39.0579 -39.0398 -39.0398 -7.1343 -7.1343 -7.1311 -7.1311
-7.0453 -7.0453 -7.0416 -7.0416 -6.4224 -6.4224 -6.2006 -6.2006
-6.1935 -6.1935 -6.0789 -6.0789 -6.0766 -6.0766 -6.0093 -6.0093
-0.7088 -0.7088 7.7354 7.7354 8.6603 8.6603 8.9207 8.9207
9.2240 9.2240 9.9072 9.9072 10.1206 10.1206 10.8058 10.8058
k = 0.0976 0.0563 0.0398 ( 9369 PWs) bands (ev):
-39.0579 -39.0579 -39.0399 -39.0399 -7.1347 -7.1347 -7.1305 -7.1305
-7.0458 -7.0458 -7.0412 -7.0412 -6.4206 -6.4206 -6.2031 -6.2031
-6.1940 -6.1940 -6.0781 -6.0781 -6.0752 -6.0752 -6.0098 -6.0098
-0.6891 -0.6891 7.5309 7.5309 8.5948 8.5948 8.8541 8.8541
9.2018 9.2018 9.9811 9.9811 10.2028 10.2028 10.9997 10.9997
k = 0.1098 0.0634 0.0448 ( 9357 PWs) bands (ev):
-39.0578 -39.0578 -39.0399 -39.0399 -7.1350 -7.1350 -7.1298 -7.1298
-7.0465 -7.0465 -7.0406 -7.0406 -6.4185 -6.4185 -6.2058 -6.2058
-6.1945 -6.1945 -6.0771 -6.0771 -6.0736 -6.0736 -6.0105 -6.0105
-0.6667 -0.6667 7.3276 7.3276 8.5308 8.5308 8.7894 8.7894
9.1769 9.1769 10.0521 10.0521 10.2807 10.2807 11.1855 11.1855
k = 0.1220 0.0704 0.0498 ( 9369 PWs) bands (ev):
-39.0577 -39.0577 -39.0400 -39.0400 -7.1354 -7.1354 -7.1291 -7.1291
-7.0472 -7.0472 -7.0401 -7.0401 -6.4163 -6.4163 -6.2087 -6.2087
-6.1951 -6.1951 -6.0761 -6.0761 -6.0720 -6.0720 -6.0111 -6.0111
-0.6417 -0.6417 7.1260 7.1260 8.4687 8.4687 8.7268 8.7268
9.1500 9.1500 10.1180 10.1180 10.3516 10.3516 11.3594 11.3594
k = 0.1341 0.0774 0.0548 ( 9375 PWs) bands (ev):
-39.0576 -39.0576 -39.0401 -39.0401 -7.1358 -7.1358 -7.1283 -7.1283
-7.0479 -7.0479 -7.0395 -7.0395 -6.4138 -6.4138 -6.2118 -6.2118
-6.1958 -6.1958 -6.0750 -6.0750 -6.0703 -6.0703 -6.0119 -6.0119
-0.6142 -0.6142 6.9265 6.9265 8.4084 8.4084 8.6664 8.6664
9.1216 9.1216 10.1759 10.1759 10.4121 10.4121 11.4929 11.4929
k = 0.1463 0.0845 0.0597 ( 9363 PWs) bands (ev):
-39.0574 -39.0574 -39.0402 -39.0402 -7.1362 -7.1362 -7.1274 -7.1274
-7.0487 -7.0487 -7.0388 -7.0388 -6.4112 -6.4112 -6.2150 -6.2150
-6.1964 -6.1964 -6.0738 -6.0738 -6.0686 -6.0686 -6.0126 -6.0126
-0.5841 -0.5841 6.7291 6.7291 8.3501 8.3501 8.6082 8.6082
9.0920 9.0920 10.2231 10.2231 10.4584 10.4584 11.5123 11.5123
k = 0.1585 0.0915 0.0647 ( 9366 PWs) bands (ev):
-39.0573 -39.0573 -39.0404 -39.0404 -7.1366 -7.1366 -7.1264 -7.1264
-7.0496 -7.0496 -7.0382 -7.0382 -6.4084 -6.4084 -6.2183 -6.2183
-6.1971 -6.1971 -6.0726 -6.0726 -6.0669 -6.0669 -6.0135 -6.0135
-0.5514 -0.5514 6.5342 6.5342 8.2938 8.2938 8.5523 8.5523
9.0616 9.0616 10.2572 10.2572 10.4871 10.4871 11.5216 11.5216
k = 0.1707 0.0986 0.0697 ( 9360 PWs) bands (ev):
-39.0572 -39.0572 -39.0405 -39.0405 -7.1370 -7.1370 -7.1254 -7.1254
-7.0505 -7.0505 -7.0375 -7.0375 -6.4055 -6.4055 -6.2217 -6.2217
-6.1978 -6.1978 -6.0713 -6.0713 -6.0652 -6.0652 -6.0144 -6.0144
-0.5163 -0.5163 6.3418 6.3418 8.2397 8.2397 8.4988 8.4988
9.0307 9.0307 10.2764 10.2764 10.4965 10.4965 11.5458 11.5458
k = 0.1829 0.1056 0.0747 ( 9348 PWs) bands (ev):
-39.0571 -39.0571 -39.0406 -39.0406 -7.1374 -7.1374 -7.1244 -7.1244
-7.0514 -7.0514 -7.0369 -7.0369 -6.4025 -6.4025 -6.2251 -6.2251
-6.1985 -6.1985 -6.0700 -6.0700 -6.0635 -6.0635 -6.0153 -6.0153
-0.4786 -0.4786 6.1522 6.1522 8.1877 8.1877 8.4476 8.4476
8.9997 8.9997 10.2805 10.2805 10.4872 10.4872 11.5876 11.5876
k = 0.1951 0.1127 0.0797 ( 9348 PWs) bands (ev):
-39.0569 -39.0569 -39.0408 -39.0408 -7.1378 -7.1378 -7.1233 -7.1233
-7.0524 -7.0524 -7.0362 -7.0362 -6.3994 -6.3994 -6.2286 -6.2286
-6.1992 -6.1992 -6.0687 -6.0687 -6.0618 -6.0618 -6.0163 -6.0163
-0.4386 -0.4386 5.9653 5.9653 8.1379 8.1379 8.3989 8.3989
8.9687 8.9687 10.2703 10.2703 10.4618 10.4618 11.6467 11.6467
k = 0.2073 0.1197 0.0846 ( 9348 PWs) bands (ev):
-39.0568 -39.0568 -39.0409 -39.0409 -7.1382 -7.1382 -7.1221 -7.1221
-7.0534 -7.0534 -7.0356 -7.0356 -6.3961 -6.3961 -6.2321 -6.2321
-6.1999 -6.1999 -6.0673 -6.0673 -6.0601 -6.0601 -6.0173 -6.0173
-0.3961 -0.3961 5.7815 5.7815 8.0904 8.0904 8.3525 8.3525
8.9379 8.9379 10.2480 10.2480 10.4239 10.4239 11.7214 11.7214
k = 0.2195 0.1267 0.0896 ( 9348 PWs) bands (ev):
-39.0566 -39.0566 -39.0411 -39.0411 -7.1385 -7.1385 -7.1209 -7.1209
-7.0544 -7.0544 -7.0349 -7.0349 -6.3928 -6.3928 -6.2357 -6.2357
-6.2006 -6.2006 -6.0660 -6.0660 -6.0585 -6.0585 -6.0183 -6.0183
-0.3513 -0.3513 5.6007 5.6007 8.0450 8.0450 8.3085 8.3085
8.9076 8.9076 10.2161 10.2161 10.3771 10.3771 11.8096 11.8096
k = 0.2317 0.1338 0.0946 ( 9342 PWs) bands (ev):
-39.0564 -39.0564 -39.0412 -39.0412 -7.1389 -7.1389 -7.1197 -7.1197
-7.0555 -7.0555 -7.0343 -7.0343 -6.3895 -6.3895 -6.2391 -6.2391
-6.2012 -6.2012 -6.0646 -6.0646 -6.0569 -6.0569 -6.0194 -6.0194
-0.3041 -0.3041 5.4231 5.4231 8.0018 8.0018 8.2668 8.2668
8.8779 8.8779 10.1768 10.1768 10.3242 10.3242 11.9087 11.9087
k = 0.2439 0.1408 0.0996 ( 9342 PWs) bands (ev):
-39.0563 -39.0563 -39.0414 -39.0414 -7.1392 -7.1392 -7.1184 -7.1184
-7.0566 -7.0566 -7.0337 -7.0337 -6.3861 -6.3861 -6.2426 -6.2426
-6.2019 -6.2019 -6.0632 -6.0632 -6.0554 -6.0554 -6.0205 -6.0205
-0.2548 -0.2548 5.2488 5.2488 7.9609 7.9609 8.2275 8.2275
8.8489 8.8489 10.1325 10.1325 10.2675 10.2675 12.0133 12.0133
k = 0.2561 0.1479 0.1046 ( 9354 PWs) bands (ev):
-39.0561 -39.0561 -39.0415 -39.0415 -7.1395 -7.1395 -7.1172 -7.1172
-7.0577 -7.0577 -7.0331 -7.0331 -6.3827 -6.3827 -6.2460 -6.2460
-6.2026 -6.2026 -6.0619 -6.0619 -6.0539 -6.0539 -6.0216 -6.0216
-0.2033 -0.2033 5.0780 5.0780 7.9221 7.9221 8.1905 8.1905
8.8208 8.8208 10.0847 10.0847 10.2086 10.2086 12.0572 12.0572
k = 0.2683 0.1549 0.1095 ( 9333 PWs) bands (ev):
-39.0559 -39.0559 -39.0417 -39.0417 -7.1398 -7.1398 -7.1159 -7.1159
-7.0588 -7.0588 -7.0326 -7.0326 -6.3794 -6.3794 -6.2493 -6.2493
-6.2032 -6.2032 -6.0605 -6.0605 -6.0525 -6.0525 -6.0227 -6.0227
-0.1498 -0.1498 4.9107 4.9107 7.8856 7.8856 8.1559 8.1559
8.7936 8.7936 10.0350 10.0350 10.1488 10.1488 12.0693 12.0693
k = 0.2805 0.1619 0.1145 ( 9327 PWs) bands (ev):
-39.0558 -39.0558 -39.0419 -39.0419 -7.1401 -7.1401 -7.1145 -7.1145
-7.0599 -7.0599 -7.0321 -7.0321 -6.3761 -6.3761 -6.2525 -6.2525
-6.2038 -6.2038 -6.0592 -6.0592 -6.0512 -6.0512 -6.0238 -6.0238
-0.0943 -0.0943 4.7471 4.7471 7.8512 7.8512 8.1234 8.1234
8.7674 8.7674 9.9844 9.9844 10.0892 10.0892 12.0795 12.0795
k = 0.2927 0.1690 0.1195 ( 9318 PWs) bands (ev):
-39.0556 -39.0556 -39.0421 -39.0421 -7.1403 -7.1403 -7.1132 -7.1132
-7.0610 -7.0610 -7.0316 -7.0316 -6.3728 -6.3728 -6.2557 -6.2557
-6.2044 -6.2044 -6.0579 -6.0579 -6.0499 -6.0499 -6.0249 -6.0249
-0.0371 -0.0371 4.5874 4.5874 7.8189 7.8189 8.0932 8.0932
8.7424 8.7424 9.9338 9.9338 10.0303 10.0303 12.0889 12.0889
k = 0.3049 0.1760 0.1245 ( 9318 PWs) bands (ev):
-39.0554 -39.0554 -39.0422 -39.0422 -7.1405 -7.1405 -7.1119 -7.1119
-7.0622 -7.0622 -7.0311 -7.0311 -6.3696 -6.3696 -6.2586 -6.2586
-6.2050 -6.2050 -6.0567 -6.0567 -6.0487 -6.0487 -6.0260 -6.0260
0.0218 0.0218 4.4318 4.4318 7.7888 7.7888 8.0652 8.0652
8.7185 8.7185 9.8838 9.8838 9.9728 9.9728 12.0978 12.0978
k = 0.3171 0.1831 0.1294 ( 9318 PWs) bands (ev):
-39.0552 -39.0552 -39.0424 -39.0424 -7.1407 -7.1407 -7.1105 -7.1105
-7.0633 -7.0633 -7.0307 -7.0307 -6.3665 -6.3665 -6.2615 -6.2615
-6.2055 -6.2055 -6.0555 -6.0555 -6.0476 -6.0476 -6.0271 -6.0271
0.0821 0.0821 4.2806 4.2806 7.7608 7.7608 8.0393 8.0393
8.6959 8.6959 9.8351 9.8351 9.9172 9.9172 12.1062 12.1062
k = 0.3293 0.1901 0.1344 ( 9339 PWs) bands (ev):
-39.0550 -39.0550 -39.0426 -39.0426 -7.1409 -7.1409 -7.1092 -7.1092
-7.0644 -7.0644 -7.0303 -7.0303 -6.3635 -6.3635 -6.2642 -6.2642
-6.2060 -6.2060 -6.0544 -6.0544 -6.0465 -6.0465 -6.0281 -6.0281
0.1437 0.1437 4.1338 4.1338 7.7348 7.7348 8.0155 8.0155
8.6745 8.6745 9.7881 9.7881 9.8638 9.8638 12.1142 12.1142
k = 0.3415 0.1971 0.1394 ( 9321 PWs) bands (ev):
-39.0549 -39.0549 -39.0428 -39.0428 -7.1410 -7.1410 -7.1078 -7.1078
-7.0656 -7.0656 -7.0299 -7.0299 -6.3607 -6.3607 -6.2668 -6.2668
-6.2065 -6.2065 -6.0533 -6.0533 -6.0455 -6.0455 -6.0292 -6.0292
0.2061 0.2061 3.9920 3.9920 7.7108 7.7108 7.9938 7.9938
8.6545 8.6545 9.7431 9.7431 9.8129 9.8129 12.1217 12.1217
k = 0.3537 0.2042 0.1444 ( 9306 PWs) bands (ev):
-39.0547 -39.0547 -39.0429 -39.0429 -7.1412 -7.1412 -7.1065 -7.1065
-7.0667 -7.0667 -7.0296 -7.0296 -6.3580 -6.3580 -6.2691 -6.2691
-6.2069 -6.2069 -6.0522 -6.0522 -6.0446 -6.0446 -6.0301 -6.0301
0.2691 0.2691 3.8553 3.8553 7.6888 7.6888 7.9739 7.9739
8.6359 8.6359 9.7005 9.7005 9.7648 9.7648 12.1287 12.1287
k = 0.3659 0.2112 0.1494 ( 9309 PWs) bands (ev):
-39.0545 -39.0545 -39.0431 -39.0431 -7.1413 -7.1413 -7.1053 -7.1053
-7.0678 -7.0678 -7.0293 -7.0293 -6.3555 -6.3555 -6.2713 -6.2713
-6.2074 -6.2074 -6.0513 -6.0513 -6.0438 -6.0438 -6.0311 -6.0311
0.3323 0.3323 3.7244 3.7244 7.6688 7.6688 7.9560 7.9560
8.6186 8.6186 9.6605 9.6605 9.7198 9.7198 12.1353 12.1353
k = 0.3780 0.2183 0.1543 ( 9318 PWs) bands (ev):
-39.0544 -39.0544 -39.0432 -39.0432 -7.1414 -7.1414 -7.1040 -7.1040
-7.0688 -7.0688 -7.0290 -7.0290 -6.3532 -6.3532 -6.2733 -6.2733
-6.2077 -6.2077 -6.0504 -6.0504 -6.0431 -6.0431 -6.0319 -6.0319
0.3951 0.3951 3.5996 3.5996 7.6506 7.6506 7.9400 7.9400
8.6028 8.6028 9.6233 9.6233 9.6780 9.6780 12.1414 12.1414
k = 0.3902 0.2253 0.1593 ( 9318 PWs) bands (ev):
-39.0542 -39.0542 -39.0434 -39.0434 -7.1414 -7.1414 -7.1028 -7.1028
-7.0698 -7.0698 -7.0288 -7.0288 -6.3510 -6.3510 -6.2751 -6.2751
-6.2081 -6.2081 -6.0496 -6.0496 -6.0424 -6.0424 -6.0327 -6.0327
0.4570 0.4570 3.4817 3.4817 7.6344 7.6344 7.9257 7.9257
8.5884 8.5884 9.5892 9.5892 9.6397 9.6397 12.1470 12.1470
k = 0.4024 0.2323 0.1643 ( 9321 PWs) bands (ev):
-39.0541 -39.0541 -39.0435 -39.0435 -7.1415 -7.1415 -7.1016 -7.1016
-7.0708 -7.0708 -7.0286 -7.0286 -6.3491 -6.3491 -6.2767 -6.2767
-6.2084 -6.2084 -6.0488 -6.0488 -6.0418 -6.0418 -6.0335 -6.0335
0.5171 0.5171 3.3713 3.3713 7.6200 7.6200 7.9131 7.9131
8.5755 8.5755 9.5583 9.5583 9.6050 9.6050 12.1521 12.1521
k = 0.4146 0.2394 0.1693 ( 9327 PWs) bands (ev):
-39.0539 -39.0539 -39.0437 -39.0437 -7.1415 -7.1415 -7.1006 -7.1006
-7.0718 -7.0718 -7.0284 -7.0284 -6.3474 -6.3474 -6.2781 -6.2781
-6.2086 -6.2086 -6.0482 -6.0482 -6.0413 -6.0413 -6.0341 -6.0341
0.5747 0.5747 3.2694 3.2694 7.6073 7.6073 7.9022 7.9022
8.5640 8.5640 9.5307 9.5307 9.5740 9.5740 12.1566 12.1566
k = 0.4268 0.2464 0.1743 ( 9315 PWs) bands (ev):
-39.0538 -39.0538 -39.0438 -39.0438 -7.1416 -7.1416 -7.0996 -7.0996
-7.0726 -7.0726 -7.0283 -7.0283 -6.3460 -6.3460 -6.2793 -6.2793
-6.2089 -6.2089 -6.0476 -6.0476 -6.0409 -6.0409 -6.0347 -6.0347
0.6286 0.6286 3.1771 3.1771 7.5965 7.5965 7.8929 7.8929
8.5541 8.5541 9.5065 9.5065 9.5469 9.5469 12.1606 12.1606
k = 0.4390 0.2535 0.1792 ( 9327 PWs) bands (ev):
-39.0537 -39.0537 -39.0439 -39.0439 -7.1416 -7.1416 -7.0986 -7.0986
-7.0734 -7.0734 -7.0281 -7.0281 -6.3448 -6.3448 -6.2803 -6.2803
-6.2091 -6.2091 -6.0471 -6.0471 -6.0406 -6.0406 -6.0351 -6.0351
0.6777 0.6777 3.0954 3.0954 7.5873 7.5873 7.8851 7.8851
8.5456 8.5456 9.4859 9.4859 9.5237 9.5237 12.1639 12.1639
k = 0.4512 0.2605 0.1842 ( 9339 PWs) bands (ev):
-39.0536 -39.0536 -39.0440 -39.0440 -7.1416 -7.1416 -7.0979 -7.0979
-7.0741 -7.0741 -7.0280 -7.0280 -6.3437 -6.3437 -6.2811 -6.2811
-6.2092 -6.2092 -6.0467 -6.0467 -6.0404 -6.0404 -6.0355 -6.0355
0.7206 0.7206 3.0259 3.0259 7.5799 7.5799 7.8788 7.8788
8.5387 8.5387 9.4690 9.4690 9.5047 9.5047 12.1667 12.1667
k = 0.4634 0.2676 0.1892 ( 9351 PWs) bands (ev):
-39.0536 -39.0536 -39.0441 -39.0441 -7.1416 -7.1416 -7.0972 -7.0972
-7.0747 -7.0747 -7.0280 -7.0280 -6.3430 -6.3430 -6.2817 -6.2817
-6.2094 -6.2094 -6.0464 -6.0464 -6.0402 -6.0402 -6.0357 -6.0357
0.7560 0.7560 2.9698 2.9698 7.5741 7.5741 7.8739 7.8739
8.5333 8.5333 9.4557 9.4557 9.4898 9.4898 12.1689 12.1689
k = 0.4756 0.2746 0.1942 ( 9357 PWs) bands (ev):
-39.0535 -39.0535 -39.0441 -39.0441 -7.1417 -7.1417 -7.0967 -7.0967
-7.0751 -7.0751 -7.0279 -7.0279 -6.3424 -6.3424 -6.2821 -6.2821
-6.2095 -6.2095 -6.0461 -6.0461 -6.0401 -6.0401 -6.0359 -6.0359
0.7824 0.7824 2.9286 2.9286 7.5700 7.5700 7.8705 7.8705
8.5295 8.5295 9.4462 9.4462 9.4791 9.4791 12.1705 12.1705
k = 0.4878 0.2816 0.1991 ( 9360 PWs) bands (ev):
-39.0535 -39.0535 -39.0441 -39.0441 -7.1417 -7.1417 -7.0964 -7.0964
-7.0754 -7.0754 -7.0279 -7.0279 -6.3421 -6.3421 -6.2824 -6.2824
-6.2095 -6.2095 -6.0460 -6.0460 -6.0400 -6.0400 -6.0360 -6.0360
0.7988 0.7988 2.9033 2.9033 7.5676 7.5676 7.8685 7.8685
8.5272 8.5272 9.4405 9.4405 9.4726 9.4726 12.1714 12.1714
k = 0.5000 0.2887 0.2041 ( 9360 PWs) bands (ev):
-39.0535 -39.0535 -39.0441 -39.0441 -7.1417 -7.1417 -7.0963 -7.0963
-7.0755 -7.0755 -7.0279 -7.0279 -6.3420 -6.3420 -6.2825 -6.2825
-6.2095 -6.2095 -6.0459 -6.0459 -6.0400 -6.0400 -6.0361 -6.0361
0.8043 0.8043 2.8948 2.8948 7.5667 7.5667 7.8678 7.8678
8.5264 8.5264 9.4386 9.4386 9.4705 9.4705 12.1717 12.1717
k = 0.5000 0.2887 0.2041 ( 9360 PWs) bands (ev):
-39.0535 -39.0535 -39.0441 -39.0441 -7.1417 -7.1417 -7.0963 -7.0963
-7.0755 -7.0755 -7.0279 -7.0279 -6.3420 -6.3420 -6.2825 -6.2825
-6.2095 -6.2095 -6.0459 -6.0459 -6.0400 -6.0400 -6.0361 -6.0361
0.8043 0.8043 2.8948 2.8948 7.5667 7.5667 7.8678 7.8678
8.5264 8.5264 9.4386 9.4386 9.4705 9.4705 12.1717 12.1717
k = 0.5043 0.2762 0.2112 ( 9360 PWs) bands (ev):
-39.0535 -39.0535 -39.0441 -39.0441 -7.1417 -7.1417 -7.0964 -7.0964
-7.0755 -7.0755 -7.0278 -7.0278 -6.3419 -6.3419 -6.2824 -6.2824
-6.2095 -6.2095 -6.0478 -6.0478 -6.0407 -6.0407 -6.0336 -6.0336
0.8057 0.8057 2.8954 2.8954 7.5480 7.5480 7.8427 7.8427
8.5567 8.5567 9.4472 9.4472 9.4777 9.4777 12.1769 12.1769
k = 0.5086 0.2638 0.2182 ( 9352 PWs) bands (ev):
-39.0535 -39.0535 -39.0442 -39.0442 -7.1417 -7.1417 -7.0965 -7.0965
-7.0756 -7.0756 -7.0275 -7.0275 -6.3418 -6.3418 -6.2822 -6.2822
-6.2096 -6.2096 -6.0519 -6.0519 -6.0410 -6.0410 -6.0294 -6.0294
0.8099 0.8099 2.8971 2.8971 7.4908 7.4908 7.7840 7.7840
8.6316 8.6316 9.4715 9.4715 9.5016 9.5016 12.1922 12.1922
k = 0.5129 0.2513 0.2252 ( 9342 PWs) bands (ev):
-39.0534 -39.0534 -39.0442 -39.0442 -7.1418 -7.1418 -7.0967 -7.0967
-7.0756 -7.0756 -7.0270 -7.0270 -6.3417 -6.3417 -6.2819 -6.2819
-6.2096 -6.2096 -6.0567 -6.0567 -6.0411 -6.0411 -6.0249 -6.0249
0.8168 0.8168 2.9001 2.9001 7.3966 7.3966 7.7160 7.7160
8.7228 8.7228 9.5101 9.5101 9.5461 9.5461 12.2175 12.2175
k = 0.5172 0.2389 0.2323 ( 9338 PWs) bands (ev):
-39.0534 -39.0534 -39.0442 -39.0442 -7.1420 -7.1420 -7.0969 -7.0969
-7.0757 -7.0757 -7.0263 -7.0263 -6.3414 -6.3414 -6.2815 -6.2815
-6.2096 -6.2096 -6.0617 -6.0617 -6.0411 -6.0411 -6.0203 -6.0203
0.8265 0.8265 2.9041 2.9041 7.2740 7.2740 7.6482 7.6482
8.8091 8.8091 9.5670 9.5670 9.6103 9.6103 12.2525 12.2525
k = 0.5216 0.2265 0.2393 ( 9334 PWs) bands (ev):
-39.0533 -39.0533 -39.0443 -39.0443 -7.1421 -7.1421 -7.0973 -7.0973
-7.0758 -7.0758 -7.0256 -7.0256 -6.3411 -6.3411 -6.2809 -6.2809
-6.2097 -6.2097 -6.0669 -6.0669 -6.0410 -6.0410 -6.0159 -6.0159
0.8390 0.8390 2.9092 2.9092 7.1340 7.1340 7.5802 7.5802
8.8779 8.8779 9.6473 9.6473 9.6916 9.6916 12.2968 12.2968
k = 0.5259 0.2140 0.2464 ( 9334 PWs) bands (ev):
-39.0533 -39.0533 -39.0443 -39.0443 -7.1423 -7.1423 -7.0978 -7.0978
-7.0758 -7.0758 -7.0247 -7.0247 -6.3407 -6.3407 -6.2803 -6.2803
-6.2098 -6.2098 -6.0721 -6.0721 -6.0409 -6.0409 -6.0115 -6.0115
0.8542 0.8542 2.9152 2.9152 6.9846 6.9846 7.5105 7.5105
8.9244 8.9244 9.7490 9.7490 9.7900 9.7900 12.3497 12.3497
k = 0.5302 0.2016 0.2534 ( 9339 PWs) bands (ev):
-39.0532 -39.0532 -39.0444 -39.0444 -7.1425 -7.1425 -7.0984 -7.0984
-7.0757 -7.0757 -7.0237 -7.0237 -6.3403 -6.3403 -6.2795 -6.2795
-6.2099 -6.2099 -6.0774 -6.0774 -6.0408 -6.0408 -6.0073 -6.0073
0.8722 0.8722 2.9220 2.9220 6.8307 6.8307 7.4390 7.4390
8.9504 8.9504 9.8619 9.8619 9.9098 9.9098 12.4103 12.4103
k = 0.5345 0.1891 0.2604 ( 9334 PWs) bands (ev):
-39.0531 -39.0531 -39.0445 -39.0445 -7.1427 -7.1427 -7.0992 -7.0992
-7.0755 -7.0755 -7.0226 -7.0226 -6.3399 -6.3399 -6.2786 -6.2786
-6.2100 -6.2100 -6.0827 -6.0827 -6.0407 -6.0407 -6.0031 -6.0031
0.8929 0.8929 2.9295 2.9295 6.6752 6.6752 7.3657 7.3657
8.9606 8.9606 9.9784 9.9784 10.0509 10.0509 12.4774 12.4774
k = 0.5388 0.1767 0.2675 ( 9336 PWs) bands (ev):
-39.0531 -39.0531 -39.0445 -39.0445 -7.1429 -7.1429 -7.1000 -7.1000
-7.0752 -7.0752 -7.0215 -7.0215 -6.3394 -6.3394 -6.2775 -6.2775
-6.2101 -6.2101 -6.0879 -6.0879 -6.0405 -6.0405 -5.9992 -5.9992
0.9164 0.9164 2.9374 2.9374 6.5199 6.5199 7.2914 7.2914
8.9595 8.9595 10.0995 10.0995 10.2055 10.2055 12.5491 12.5491
k = 0.5431 0.1642 0.2745 ( 9337 PWs) bands (ev):
-39.0530 -39.0530 -39.0446 -39.0446 -7.1430 -7.1430 -7.1010 -7.1010
-7.0748 -7.0748 -7.0204 -7.0204 -6.3388 -6.3388 -6.2764 -6.2764
-6.2102 -6.2102 -6.0932 -6.0932 -6.0403 -6.0403 -5.9954 -5.9954
0.9426 0.9426 2.9455 2.9455 6.3662 6.3662 7.2167 7.2167
8.9506 8.9506 10.2261 10.2261 10.3674 10.3674 12.6220 12.6220
k = 0.5474 0.1518 0.2816 ( 9333 PWs) bands (ev):
-39.0529 -39.0529 -39.0447 -39.0447 -7.1432 -7.1432 -7.1020 -7.1020
-7.0743 -7.0743 -7.0194 -7.0194 -6.3383 -6.3383 -6.2751 -6.2751
-6.2103 -6.2103 -6.0984 -6.0984 -6.0401 -6.0401 -5.9918 -5.9918
0.9716 0.9716 2.9536 2.9536 6.2151 6.2151 7.1420 7.1420
8.9362 8.9362 10.3580 10.3580 10.5326 10.5326 12.6905 12.6905
k = 0.5517 0.1394 0.2886 ( 9331 PWs) bands (ev):
-39.0527 -39.0527 -39.0448 -39.0448 -7.1434 -7.1434 -7.1031 -7.1031
-7.0737 -7.0737 -7.0183 -7.0183 -6.3377 -6.3377 -6.2737 -6.2737
-6.2104 -6.2104 -6.1035 -6.1035 -6.0399 -6.0399 -5.9883 -5.9883
1.0032 1.0032 2.9613 2.9613 6.0674 6.0674 7.0679 7.0679
8.9181 8.9181 10.4948 10.4948 10.6983 10.6983 12.7444 12.7444
k = 0.5560 0.1269 0.2956 ( 9336 PWs) bands (ev):
-39.0526 -39.0526 -39.0450 -39.0450 -7.1435 -7.1435 -7.1042 -7.1042
-7.0731 -7.0731 -7.0173 -7.0173 -6.3371 -6.3371 -6.2723 -6.2723
-6.2105 -6.2105 -6.1086 -6.1086 -6.0397 -6.0397 -5.9851 -5.9851
1.0376 1.0376 2.9682 2.9682 5.9239 5.9239 6.9949 6.9949
8.8975 8.8975 10.6362 10.6362 10.8618 10.8618 12.7689 12.7689
k = 0.5603 0.1145 0.3027 ( 9337 PWs) bands (ev):
-39.0525 -39.0525 -39.0451 -39.0451 -7.1436 -7.1436 -7.1054 -7.1054
-7.0723 -7.0723 -7.0164 -7.0164 -6.3365 -6.3365 -6.2707 -6.2707
-6.2106 -6.2106 -6.1136 -6.1136 -6.0394 -6.0394 -5.9821 -5.9821
1.0745 1.0745 2.9739 2.9739 5.7855 5.7855 6.9232 6.9232
8.8752 8.8752 10.7817 10.7817 11.0204 11.0204 12.7535 12.7535
k = 0.5647 0.1020 0.3097 ( 9331 PWs) bands (ev):
-39.0524 -39.0524 -39.0452 -39.0452 -7.1437 -7.1437 -7.1066 -7.1066
-7.0715 -7.0715 -7.0155 -7.0155 -6.3359 -6.3359 -6.2690 -6.2690
-6.2107 -6.2107 -6.1184 -6.1184 -6.0392 -6.0392 -5.9792 -5.9792
1.1141 1.1141 2.9777 2.9777 5.6528 5.6528 6.8532 6.8532
8.8518 8.8518 10.9310 10.9310 11.1704 11.1704 12.7050 12.7050
k = 0.5690 0.0896 0.3167 ( 9331 PWs) bands (ev):
-39.0522 -39.0522 -39.0454 -39.0454 -7.1437 -7.1437 -7.1078 -7.1078
-7.0707 -7.0707 -7.0148 -7.0148 -6.3353 -6.3353 -6.2673 -6.2673
-6.2107 -6.2107 -6.1232 -6.1232 -6.0389 -6.0389 -5.9766 -5.9766
1.1563 1.1563 2.9792 2.9792 5.5268 5.5268 6.7851 6.7851
8.8280 8.8280 11.0834 11.0834 11.3069 11.3069 12.6428 12.6428
k = 0.5733 0.0771 0.3238 ( 9333 PWs) bands (ev):
-39.0521 -39.0521 -39.0455 -39.0455 -7.1437 -7.1437 -7.1089 -7.1089
-7.0699 -7.0699 -7.0141 -7.0141 -6.3347 -6.3347 -6.2655 -6.2655
-6.2108 -6.2108 -6.1277 -6.1277 -6.0386 -6.0386 -5.9741 -5.9741
1.2009 1.2009 2.9776 2.9776 5.4083 5.4083 6.7190 6.7190
8.8041 8.8041 11.2382 11.2382 11.4224 11.4224 12.5871 12.5871
k = 0.5776 0.0647 0.3308 ( 9343 PWs) bands (ev):
-39.0519 -39.0519 -39.0457 -39.0457 -7.1436 -7.1436 -7.1101 -7.1101
-7.0690 -7.0690 -7.0135 -7.0135 -6.3341 -6.3341 -6.2637 -6.2637
-6.2108 -6.2108 -6.1322 -6.1322 -6.0382 -6.0382 -5.9719 -5.9719
1.2480 1.2480 2.9722 2.9722 5.2983 5.2983 6.6553 6.6553
8.7803 8.7803 11.3913 11.3913 11.5098 11.5098 12.5559 12.5559
k = 0.5819 0.0523 0.3379 ( 9342 PWs) bands (ev):
-39.0517 -39.0517 -39.0459 -39.0459 -7.1435 -7.1435 -7.1112 -7.1112
-7.0681 -7.0681 -7.0131 -7.0131 -6.3335 -6.3335 -6.2619 -6.2619
-6.2108 -6.2108 -6.1364 -6.1364 -6.0379 -6.0379 -5.9700 -5.9700
1.2974 1.2974 2.9623 2.9623 5.1976 5.1976 6.5940 6.5940
8.7571 8.7571 11.5049 11.5049 11.5961 11.5961 12.5635 12.5635
k = 0.5862 0.0398 0.3449 ( 9340 PWs) bands (ev):
-39.0516 -39.0516 -39.0460 -39.0460 -7.1434 -7.1434 -7.1122 -7.1122
-7.0672 -7.0672 -7.0128 -7.0128 -6.3330 -6.3330 -6.2601 -6.2601
-6.2107 -6.2107 -6.1404 -6.1404 -6.0375 -6.0375 -5.9682 -5.9682
1.3489 1.3489 2.9471 2.9471 5.1072 5.1072 6.5352 6.5352
8.7345 8.7345 11.5129 11.5129 11.7443 11.7443 12.6150 12.6150
k = 0.5905 0.0274 0.3519 ( 9334 PWs) bands (ev):
-39.0514 -39.0514 -39.0462 -39.0462 -7.1432 -7.1432 -7.1132 -7.1132
-7.0664 -7.0664 -7.0126 -7.0126 -6.3324 -6.3324 -6.2584 -6.2584
-6.2106 -6.2106 -6.1442 -6.1442 -6.0371 -6.0371 -5.9667 -5.9667
1.4024 1.4024 2.9261 2.9261 5.0280 5.0280 6.4790 6.4790
8.7129 8.7129 11.4676 11.4676 11.9096 11.9096 12.7038 12.7038
k = 0.5948 0.0149 0.3590 ( 9330 PWs) bands (ev):
-39.0512 -39.0512 -39.0464 -39.0464 -7.1430 -7.1430 -7.1141 -7.1141
-7.0655 -7.0655 -7.0125 -7.0125 -6.3319 -6.3319 -6.2568 -6.2568
-6.2104 -6.2104 -6.1477 -6.1477 -6.0367 -6.0367 -5.9653 -5.9653
1.4575 1.4575 2.8990 2.8990 4.9607 4.9607 6.4257 6.4257
8.6923 8.6923 11.3932 11.3932 12.0800 12.0800 12.8182 12.8182
k = 0.5991 0.0025 0.3660 ( 9328 PWs) bands (ev):
-39.0510 -39.0510 -39.0465 -39.0465 -7.1427 -7.1427 -7.1149 -7.1149
-7.0647 -7.0647 -7.0125 -7.0125 -6.3314 -6.3314 -6.2555 -6.2555
-6.2101 -6.2101 -6.1509 -6.1509 -6.0363 -6.0363 -5.9643 -5.9643
1.5139 1.5139 2.8656 2.8656 4.9056 4.9056 6.3751 6.3751
8.6728 8.6728 11.3015 11.3015 12.2535 12.2535 12.9481 12.9481
k = 0.6034-0.0100 0.3731 ( 9328 PWs) bands (ev):
-39.0509 -39.0509 -39.0467 -39.0467 -7.1424 -7.1424 -7.1157 -7.1157
-7.0640 -7.0640 -7.0127 -7.0127 -6.3308 -6.3308 -6.2543 -6.2543
-6.2098 -6.2098 -6.1538 -6.1538 -6.0358 -6.0358 -5.9634 -5.9634
1.5710 1.5710 2.8265 2.8265 4.8630 4.8630 6.3275 6.3275
8.6547 8.6547 11.1999 11.1999 12.4297 12.4297 13.0861 13.0861
k = 0.6078-0.0224 0.3801 ( 9316 PWs) bands (ev):
-39.0507 -39.0507 -39.0469 -39.0469 -7.1420 -7.1420 -7.1164 -7.1164
-7.0632 -7.0632 -7.0129 -7.0129 -6.3303 -6.3303 -6.2535 -6.2535
-6.2093 -6.2093 -6.1563 -6.1563 -6.0354 -6.0354 -5.9628 -5.9628
1.6280 1.6280 2.7826 2.7826 4.8327 4.8327 6.2829 6.2829
8.6380 8.6380 11.0926 11.0926 12.6079 12.6079 13.2262 13.2262
k = 0.6121-0.0348 0.3871 ( 9313 PWs) bands (ev):
-39.0505 -39.0505 -39.0470 -39.0470 -7.1416 -7.1416 -7.1170 -7.1170
-7.0625 -7.0625 -7.0133 -7.0133 -6.3298 -6.3298 -6.2530 -6.2530
-6.2087 -6.2087 -6.1584 -6.1584 -6.0349 -6.0349 -5.9624 -5.9624
1.6835 1.6835 2.7357 2.7357 4.8143 4.8143 6.2413 6.2413
8.6228 8.6228 10.9825 10.9825 12.7874 12.7874 13.3583 13.3583
k = 0.6164-0.0473 0.3942 ( 9325 PWs) bands (ev):
-39.0504 -39.0504 -39.0472 -39.0472 -7.1412 -7.1412 -7.1175 -7.1175
-7.0619 -7.0619 -7.0137 -7.0137 -6.3293 -6.3293 -6.2529 -6.2529
-6.2081 -6.2081 -6.1599 -6.1599 -6.0345 -6.0345 -5.9622 -5.9622
1.7358 1.7358 2.6883 2.6883 4.8071 4.8071 6.2028 6.2028
8.6092 8.6092 10.8712 10.8712 12.9664 12.9664 13.4312 13.4312
k = 0.6207-0.0597 0.4012 ( 9325 PWs) bands (ev):
-39.0503 -39.0503 -39.0473 -39.0473 -7.1408 -7.1408 -7.1180 -7.1180
-7.0614 -7.0614 -7.0142 -7.0142 -6.3287 -6.3287 -6.2531 -6.2531
-6.2074 -6.2074 -6.1610 -6.1610 -6.0340 -6.0340 -5.9622 -5.9622
1.7820 1.7820 2.6440 2.6440 4.8103 4.8103 6.1674 6.1674
8.5972 8.5972 10.7598 10.7598 13.1387 13.1387 13.4262 13.4262
k = 0.6250-0.0722 0.4082 ( 9330 PWs) bands (ev):
-39.0501 -39.0501 -39.0474 -39.0474 -7.1403 -7.1403 -7.1183 -7.1183
-7.0609 -7.0609 -7.0149 -7.0149 -6.3282 -6.3282 -6.2537 -6.2537
-6.2067 -6.2067 -6.1615 -6.1615 -6.0335 -6.0335 -5.9625 -5.9625
1.8180 1.8180 2.6077 2.6077 4.8229 4.8229 6.1352 6.1352
8.5869 8.5869 10.6492 10.6492 13.2692 13.2692 13.4505 13.4505
k = 0.6250-0.0722 0.4082 ( 9330 PWs) bands (ev):
-39.0501 -39.0501 -39.0474 -39.0474 -7.1403 -7.1403 -7.1183 -7.1183
-7.0609 -7.0609 -7.0149 -7.0149 -6.3282 -6.3282 -6.2537 -6.2537
-6.2067 -6.2067 -6.1615 -6.1615 -6.0335 -6.0335 -5.9625 -5.9625
1.8180 1.8180 2.6077 2.6077 4.8229 4.8229 6.1352 6.1352
8.5869 8.5869 10.6492 10.6492 13.2692 13.2692 13.4505 13.4505
k = 0.6176-0.0679 0.4203 ( 9326 PWs) bands (ev):
-39.0501 -39.0501 -39.0474 -39.0474 -7.1403 -7.1403 -7.1184 -7.1184
-7.0608 -7.0608 -7.0148 -7.0148 -6.3282 -6.3282 -6.2536 -6.2536
-6.2067 -6.2067 -6.1616 -6.1616 -6.0335 -6.0335 -5.9624 -5.9624
1.8195 1.8195 2.6069 2.6069 4.8241 4.8241 6.1262 6.1262
8.6000 8.6000 10.6492 10.6492 13.2465 13.2465 13.3860 13.3860
k = 0.6103-0.0637 0.4323 ( 9320 PWs) bands (ev):
-39.0501 -39.0501 -39.0474 -39.0474 -7.1403 -7.1403 -7.1186 -7.1186
-7.0607 -7.0607 -7.0148 -7.0148 -6.3282 -6.3282 -6.2534 -6.2534
-6.2067 -6.2067 -6.1620 -6.1620 -6.0337 -6.0337 -5.9622 -5.9622
1.8240 1.8240 2.6044 2.6044 4.8274 4.8274 6.0998 6.0998
8.6385 8.6385 10.6491 10.6491 13.1835 13.1835 13.2634 13.2634
k = 0.6029-0.0594 0.4443 ( 9317 PWs) bands (ev):
-39.0501 -39.0501 -39.0475 -39.0475 -7.1402 -7.1402 -7.1189 -7.1189
-7.0604 -7.0604 -7.0147 -7.0147 -6.3283 -6.3283 -6.2530 -6.2530
-6.2066 -6.2066 -6.1625 -6.1625 -6.0338 -6.0338 -5.9618 -5.9618
1.8315 1.8315 2.6003 2.6003 4.8329 4.8329 6.0579 6.0579
8.7006 8.7006 10.6489 10.6489 13.0899 13.0899 13.1325 13.1325
k = 0.5956-0.0552 0.4563 ( 9322 PWs) bands (ev):
-39.0501 -39.0501 -39.0475 -39.0475 -7.1402 -7.1402 -7.1194 -7.1194
-7.0601 -7.0601 -7.0145 -7.0145 -6.3284 -6.3284 -6.2525 -6.2525
-6.2065 -6.2065 -6.1633 -6.1633 -6.0341 -6.0341 -5.9613 -5.9613
1.8419 1.8419 2.5943 2.5943 4.8407 4.8407 6.0030 6.0030
8.7837 8.7837 10.6484 10.6484 12.9703 12.9703 13.0096 13.0096
k = 0.5882-0.0509 0.4683 ( 9328 PWs) bands (ev):
-39.0500 -39.0500 -39.0475 -39.0475 -7.1401 -7.1401 -7.1199 -7.1199
-7.0597 -7.0597 -7.0143 -7.0143 -6.3285 -6.3285 -6.2518 -6.2518
-6.2064 -6.2064 -6.1643 -6.1643 -6.0344 -6.0344 -5.9607 -5.9607
1.8554 1.8554 2.5863 2.5863 4.8507 4.8507 5.9381 5.9381
8.8849 8.8849 10.6475 10.6475 12.8374 12.8374 12.8923 12.8923
k = 0.5809-0.0467 0.4803 ( 9331 PWs) bands (ev):
-39.0500 -39.0500 -39.0476 -39.0476 -7.1400 -7.1400 -7.1206 -7.1206
-7.0593 -7.0593 -7.0141 -7.0141 -6.3287 -6.3287 -6.2509 -6.2509
-6.2063 -6.2063 -6.1655 -6.1655 -6.0347 -6.0347 -5.9601 -5.9601
1.8719 1.8719 2.5762 2.5762 4.8628 4.8628 5.8660 5.8660
9.0013 9.0013 10.6460 10.6460 12.7031 12.7031 12.7748 12.7748
k = 0.5735-0.0425 0.4923 ( 9327 PWs) bands (ev):
-39.0499 -39.0499 -39.0477 -39.0477 -7.1399 -7.1399 -7.1212 -7.1212
-7.0589 -7.0589 -7.0139 -7.0139 -6.3288 -6.3288 -6.2500 -6.2500
-6.2062 -6.2062 -6.1668 -6.1668 -6.0350 -6.0350 -5.9594 -5.9594
1.8914 1.8914 2.5638 2.5638 4.8770 4.8770 5.7895 5.7895
9.1302 9.1302 10.6436 10.6436 12.5708 12.5708 12.6575 12.6575
k = 0.5662-0.0382 0.5043 ( 9331 PWs) bands (ev):
-39.0498 -39.0498 -39.0477 -39.0477 -7.1398 -7.1398 -7.1220 -7.1220
-7.0584 -7.0584 -7.0136 -7.0136 -6.3290 -6.3290 -6.2490 -6.2490
-6.2060 -6.2060 -6.1683 -6.1683 -6.0354 -6.0354 -5.9586 -5.9586
1.9138 1.9138 2.5487 2.5487 4.8934 4.8934 5.7107 5.7107
9.2689 9.2689 10.6400 10.6400 12.4418 12.4418 12.5418 12.5418
k = 0.5588-0.0340 0.5163 ( 9330 PWs) bands (ev):
-39.0498 -39.0498 -39.0478 -39.0478 -7.1396 -7.1396 -7.1227 -7.1227
-7.0579 -7.0579 -7.0133 -7.0133 -6.3292 -6.3292 -6.2478 -6.2478
-6.2058 -6.2058 -6.1698 -6.1698 -6.0357 -6.0357 -5.9578 -5.9578
1.9393 1.9393 2.5308 2.5308 4.9118 4.9118 5.6319 5.6319
9.4150 9.4150 10.6347 10.6347 12.3171 12.3171 12.4292 12.4292
k = 0.5515-0.0297 0.5283 ( 9344 PWs) bands (ev):
-39.0497 -39.0497 -39.0479 -39.0479 -7.1395 -7.1395 -7.1234 -7.1234
-7.0575 -7.0575 -7.0131 -7.0131 -6.3293 -6.3293 -6.2467 -6.2467
-6.2057 -6.2057 -6.1715 -6.1715 -6.0361 -6.0361 -5.9571 -5.9571
1.9678 1.9678 2.5098 2.5098 4.9321 4.9321 5.5547 5.5547
9.5664 9.5664 10.6272 10.6272 12.1980 12.1980 12.3208 12.3208
k = 0.5441-0.0255 0.5403 ( 9346 PWs) bands (ev):
-39.0496 -39.0496 -39.0480 -39.0480 -7.1394 -7.1394 -7.1240 -7.1240
-7.0571 -7.0571 -7.0128 -7.0128 -6.3295 -6.3295 -6.2455 -6.2455
-6.2055 -6.2055 -6.1731 -6.1731 -6.0364 -6.0364 -5.9564 -5.9564
1.9992 1.9992 2.4854 2.4854 4.9544 4.9544 5.4805 5.4805
9.7204 9.7204 10.6169 10.6169 12.0858 12.0858 12.2179 12.2179
k = 0.5368-0.0212 0.5523 ( 9342 PWs) bands (ev):
-39.0495 -39.0495 -39.0481 -39.0481 -7.1393 -7.1393 -7.1246 -7.1246
-7.0567 -7.0567 -7.0125 -7.0125 -6.3297 -6.3297 -6.2443 -6.2443
-6.2053 -6.2053 -6.1747 -6.1747 -6.0366 -6.0366 -5.9557 -5.9557
2.0337 2.0337 2.4573 2.4573 4.9784 4.9784 5.4107 5.4107
9.8740 9.8740 10.6031 10.6031 11.9828 11.9828 12.1215 12.1215
k = 0.5294-0.0170 0.5643 ( 9340 PWs) bands (ev):
-39.0493 -39.0493 -39.0482 -39.0482 -7.1392 -7.1392 -7.1252 -7.1252
-7.0564 -7.0564 -7.0123 -7.0123 -6.3298 -6.3298 -6.2432 -6.2432
-6.2052 -6.2052 -6.1761 -6.1761 -6.0368 -6.0368 -5.9551 -5.9551
2.0711 2.0711 2.4254 2.4254 5.0038 5.0038 5.3465 5.3465
10.0233 10.0233 10.5852 10.5852 11.8919 11.8919 12.0327 12.0327
k = 0.5221-0.0127 0.5764 ( 9346 PWs) bands (ev):
-39.0492 -39.0492 -39.0484 -39.0484 -7.1391 -7.1391 -7.1256 -7.1256
-7.0562 -7.0562 -7.0121 -7.0121 -6.3299 -6.3299 -6.2422 -6.2422
-6.2050 -6.2050 -6.1774 -6.1774 -6.0370 -6.0370 -5.9547 -5.9547
2.1114 2.1114 2.3896 2.3896 5.0302 5.0302 5.2893 5.2893
10.1629 10.1629 10.5626 10.5626 11.8179 11.8179 11.9526 11.9526
k = 0.5147-0.0085 0.5884 ( 9336 PWs) bands (ev):
-39.0491 -39.0491 -39.0485 -39.0485 -7.1390 -7.1390 -7.1259 -7.1259
-7.0560 -7.0560 -7.0120 -7.0120 -6.3300 -6.3300 -6.2415 -6.2415
-6.2049 -6.2049 -6.1784 -6.1784 -6.0371 -6.0371 -5.9543 -5.9543
2.1543 2.1543 2.3498 2.3498 5.0562 5.0562 5.2407 5.2407
10.2850 10.2850 10.5353 10.5353 11.7675 11.7675 11.8821 11.8821
k = 0.5074-0.0042 0.6004 ( 9333 PWs) bands (ev):
-39.0489 -39.0489 -39.0486 -39.0486 -7.1390 -7.1390 -7.1261 -7.1261
-7.0559 -7.0559 -7.0119 -7.0119 -6.3301 -6.3301 -6.2410 -6.2410
-6.2049 -6.2049 -6.1791 -6.1791 -6.0372 -6.0372 -5.9541 -5.9541
2.1989 2.1989 2.3071 2.3071 5.0784 5.0784 5.2048 5.2048
10.3779 10.3779 10.5054 10.5054 11.7491 11.7491 11.8219 11.8219
k = 0.5000-0.0000 0.6124 ( 9340 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1390 -7.1390 -7.1261 -7.1261
-7.0559 -7.0559 -7.0118 -7.0118 -6.3301 -6.3301 -6.2408 -6.2408
-6.2048 -6.2048 -6.1793 -6.1793 -6.0372 -6.0372 -5.9540 -5.9540
2.2314 2.2314 2.2752 2.2752 5.0880 5.0880 5.1906 5.1906
10.4175 10.4175 10.4881 10.4881 11.7661 11.7661 11.7773 11.7773
k = 0.5000-0.0000 0.6124 ( 9340 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1390 -7.1390 -7.1261 -7.1261
-7.0559 -7.0559 -7.0118 -7.0118 -6.3301 -6.3301 -6.2408 -6.2408
-6.2048 -6.2048 -6.1793 -6.1793 -6.0372 -6.0372 -5.9540 -5.9540
2.2314 2.2314 2.2752 2.2752 5.0880 5.0880 5.1906 5.1906
10.4175 10.4175 10.4881 10.4881 11.7661 11.7661 11.7773 11.7773
k = 0.5000 0.0087 0.6000 ( 9336 PWs) bands (ev):
-39.0490 -39.0490 -39.0486 -39.0486 -7.1390 -7.1390 -7.1260 -7.1260
-7.0560 -7.0560 -7.0118 -7.0118 -6.3301 -6.3301 -6.2409 -6.2409
-6.2050 -6.2050 -6.1790 -6.1790 -6.0372 -6.0372 -5.9541 -5.9541
2.1752 2.1752 2.3309 2.3309 5.0693 5.0693 5.2151 5.2151
10.3764 10.3764 10.5256 10.5256 11.7110 11.7110 11.8401 11.8401
k = 0.5000 0.0175 0.5876 ( 9338 PWs) bands (ev):
-39.0492 -39.0492 -39.0483 -39.0483 -7.1392 -7.1392 -7.1257 -7.1257
-7.0562 -7.0562 -7.0118 -7.0118 -6.3302 -6.3302 -6.2413 -6.2413
-6.2053 -6.2053 -6.1780 -6.1780 -6.0373 -6.0373 -5.9543 -5.9543
2.1019 2.1019 2.4028 2.4028 5.0357 5.0357 5.2659 5.2659
10.3111 10.3111 10.5796 10.5796 11.6606 11.6606 11.9139 11.9139
k = 0.5000 0.0262 0.5753 ( 9340 PWs) bands (ev):
-39.0495 -39.0495 -39.0481 -39.0481 -7.1395 -7.1395 -7.1252 -7.1252
-7.0565 -7.0565 -7.0117 -7.0117 -6.3303 -6.3303 -6.2420 -6.2420
-6.2059 -6.2059 -6.1764 -6.1764 -6.0373 -6.0373 -5.9546 -5.9546
2.0280 2.0280 2.4740 2.4740 5.0038 5.0038 5.3268 5.3268
10.2422 10.2422 10.6275 10.6275 11.6230 11.6230 11.9924 11.9924
k = 0.5000 0.0350 0.5629 ( 9340 PWs) bands (ev):
-39.0497 -39.0497 -39.0479 -39.0479 -7.1399 -7.1399 -7.1246 -7.1246
-7.0570 -7.0570 -7.0116 -7.0116 -6.3304 -6.3304 -6.2430 -6.2430
-6.2065 -6.2065 -6.1744 -6.1744 -6.0374 -6.0374 -5.9551 -5.9551
1.9547 1.9547 2.5432 2.5432 4.9778 4.9778 5.3939 5.3939
10.1727 10.1727 10.6641 10.6641 11.6015 11.6015 12.0745 12.0745
k = 0.5000 0.0437 0.5505 ( 9346 PWs) bands (ev):
-39.0499 -39.0499 -39.0477 -39.0477 -7.1403 -7.1403 -7.1237 -7.1237
-7.0576 -7.0576 -7.0116 -7.0116 -6.3305 -6.3305 -6.2441 -6.2441
-6.2072 -6.2072 -6.1719 -6.1719 -6.0374 -6.0374 -5.9557 -5.9557
1.8823 1.8823 2.6094 2.6094 4.9595 4.9595 5.4656 5.4656
10.1036 10.1036 10.6859 10.6859 11.5992 11.5992 12.1591 12.1591
k = 0.5000 0.0525 0.5381 ( 9334 PWs) bands (ev):
-39.0501 -39.0501 -39.0475 -39.0475 -7.1407 -7.1407 -7.1228 -7.1228
-7.0584 -7.0584 -7.0115 -7.0115 -6.3307 -6.3307 -6.2455 -6.2455
-6.2078 -6.2078 -6.1691 -6.1691 -6.0375 -6.0375 -5.9565 -5.9565
1.8113 1.8113 2.6717 2.6717 4.9501 4.9501 5.5413 5.5413
10.0354 10.0354 10.6912 10.6912 11.6176 11.6176 12.2455 12.2455
k = 0.5000 0.0612 0.5258 ( 9338 PWs) bands (ev):
-39.0503 -39.0503 -39.0473 -39.0473 -7.1411 -7.1411 -7.1218 -7.1218
-7.0592 -7.0592 -7.0114 -7.0114 -6.3310 -6.3310 -6.2471 -6.2471
-6.2084 -6.2084 -6.1660 -6.1660 -6.0376 -6.0376 -5.9574 -5.9574
1.7419 1.7419 2.7294 2.7294 4.9506 4.9506 5.6206 5.6206
9.9685 9.9685 10.6804 10.6804 11.6562 11.6562 12.3323 12.3323
k = 0.5000 0.0700 0.5134 ( 9332 PWs) bands (ev):
-39.0505 -39.0505 -39.0471 -39.0471 -7.1415 -7.1415 -7.1207 -7.1207
-7.0601 -7.0601 -7.0114 -7.0114 -6.3312 -6.3312 -6.2488 -6.2488
-6.2089 -6.2089 -6.1627 -6.1627 -6.0377 -6.0377 -5.9584 -5.9584
1.6743 1.6743 2.7818 2.7818 4.9616 4.9616 5.7031 5.7031
9.9032 9.9032 10.6556 10.6556 11.7125 11.7125 12.4183 12.4183
k = 0.5000 0.0787 0.5010 ( 9332 PWs) bands (ev):
-39.0507 -39.0507 -39.0469 -39.0469 -7.1419 -7.1419 -7.1195 -7.1195
-7.0611 -7.0611 -7.0114 -7.0114 -6.3315 -6.3315 -6.2507 -6.2507
-6.2094 -6.2094 -6.1591 -6.1591 -6.0379 -6.0379 -5.9596 -5.9596
1.6087 1.6087 2.8282 2.8282 4.9840 4.9840 5.7885 5.7885
9.8397 9.8397 10.6201 10.6201 11.7833 11.7833 12.5008 12.5008
k = 0.5000 0.0875 0.4887 ( 9334 PWs) bands (ev):
-39.0509 -39.0509 -39.0467 -39.0467 -7.1423 -7.1423 -7.1183 -7.1183
-7.0621 -7.0621 -7.0115 -7.0115 -6.3319 -6.3319 -6.2526 -6.2526
-6.2097 -6.2097 -6.1554 -6.1554 -6.0380 -6.0380 -5.9610 -5.9610
1.5451 1.5451 2.8682 2.8682 5.0180 5.0180 5.8766 5.8766
9.7781 9.7781 10.5767 10.5767 11.8654 11.8654 12.5755 12.5755
k = 0.5000 0.0962 0.4763 ( 9336 PWs) bands (ev):
-39.0511 -39.0511 -39.0465 -39.0465 -7.1427 -7.1427 -7.1171 -7.1171
-7.0632 -7.0632 -7.0117 -7.0117 -6.3322 -6.3322 -6.2547 -6.2547
-6.2100 -6.2100 -6.1515 -6.1515 -6.0382 -6.0382 -5.9625 -5.9625
1.4838 1.4838 2.9017 2.9017 5.0639 5.0639 5.9669 5.9669
9.7185 9.7185 10.5278 10.5278 11.9559 11.9559 12.6340 12.6340
k = 0.5000 0.1050 0.4639 ( 9334 PWs) bands (ev):
-39.0513 -39.0513 -39.0463 -39.0463 -7.1429 -7.1429 -7.1157 -7.1157
-7.0643 -7.0643 -7.0119 -7.0119 -6.3326 -6.3326 -6.2567 -6.2567
-6.2102 -6.2102 -6.1473 -6.1473 -6.0383 -6.0383 -5.9642 -5.9642
1.4248 1.4248 2.9287 2.9287 5.1216 5.1216 6.0594 6.0594
9.6610 9.6610 10.4751 10.4751 12.0525 12.0525 12.6594 12.6594
k = 0.5000 0.1137 0.4515 ( 9328 PWs) bands (ev):
-39.0515 -39.0515 -39.0461 -39.0461 -7.1432 -7.1432 -7.1144 -7.1144
-7.0654 -7.0654 -7.0123 -7.0123 -6.3331 -6.3331 -6.2588 -6.2588
-6.2104 -6.2104 -6.1431 -6.1431 -6.0385 -6.0385 -5.9661 -5.9661
1.3682 1.3682 2.9494 2.9494 5.1909 5.1909 6.1538 6.1538
9.6057 9.6057 10.4200 10.4200 12.1526 12.1526 12.6272 12.6272
k = 0.5000 0.1225 0.4392 ( 9328 PWs) bands (ev):
-39.0517 -39.0517 -39.0459 -39.0459 -7.1434 -7.1434 -7.1130 -7.1130
-7.0666 -7.0666 -7.0127 -7.0127 -6.3336 -6.3336 -6.2608 -6.2608
-6.2105 -6.2105 -6.1387 -6.1387 -6.0387 -6.0387 -5.9681 -5.9681
1.3141 1.3141 2.9644 2.9644 5.2712 5.2712 6.2498 6.2498
9.5525 9.5525 10.3633 10.3633 12.2511 12.2511 12.5264 12.5264
k = 0.5000 0.1312 0.4268 ( 9320 PWs) bands (ev):
-39.0518 -39.0518 -39.0457 -39.0457 -7.1435 -7.1435 -7.1117 -7.1117
-7.0677 -7.0677 -7.0132 -7.0132 -6.3341 -6.3341 -6.2629 -6.2629
-6.2106 -6.2106 -6.1341 -6.1341 -6.0389 -6.0389 -5.9704 -5.9704
1.2626 1.2626 2.9741 2.9741 5.3619 5.3619 6.3472 6.3472
9.5014 9.5014 10.3056 10.3056 12.2971 12.2971 12.4221 12.4221
k = 0.5000 0.1400 0.4144 ( 9318 PWs) bands (ev):
-39.0520 -39.0520 -39.0456 -39.0456 -7.1436 -7.1436 -7.1103 -7.1103
-7.0687 -7.0687 -7.0138 -7.0138 -6.3346 -6.3346 -6.2648 -6.2648
-6.2106 -6.2106 -6.1294 -6.1294 -6.0391 -6.0391 -5.9728 -5.9728
1.2136 1.2136 2.9795 2.9795 5.4622 5.4622 6.4457 6.4457
9.4524 9.4524 10.2472 10.2472 12.1411 12.1411 12.4867 12.4867
k = 0.5000 0.1487 0.4021 ( 9304 PWs) bands (ev):
-39.0522 -39.0522 -39.0454 -39.0454 -7.1437 -7.1437 -7.1089 -7.1089
-7.0698 -7.0698 -7.0145 -7.0145 -6.3352 -6.3352 -6.2667 -6.2667
-6.2106 -6.2106 -6.1246 -6.1246 -6.0393 -6.0393 -5.9754 -5.9754
1.1673 1.1673 2.9810 2.9810 5.5714 5.5714 6.5450 6.5450
9.4055 9.4055 10.1884 10.1884 11.9357 11.9357 12.5795 12.5795
k = 0.5000 0.1575 0.3897 ( 9316 PWs) bands (ev):
-39.0523 -39.0523 -39.0453 -39.0453 -7.1437 -7.1437 -7.1075 -7.1075
-7.0708 -7.0708 -7.0153 -7.0153 -6.3358 -6.3358 -6.2686 -6.2686
-6.2106 -6.2106 -6.1197 -6.1197 -6.0395 -6.0395 -5.9781 -5.9781
1.1237 1.1237 2.9795 2.9795 5.6886 5.6886 6.6448 6.6448
9.3605 9.3605 10.1296 10.1296 11.7201 11.7201 12.6627 12.6627
k = 0.5000 0.1662 0.3773 ( 9320 PWs) bands (ev):
-39.0525 -39.0525 -39.0451 -39.0451 -7.1436 -7.1436 -7.1061 -7.1061
-7.0717 -7.0717 -7.0162 -7.0162 -6.3364 -6.3364 -6.2703 -6.2703
-6.2105 -6.2105 -6.1147 -6.1147 -6.0397 -6.0397 -5.9811 -5.9811
1.0828 1.0828 2.9756 2.9756 5.8131 5.8131 6.7448 6.7448
9.3172 9.3172 10.0707 10.0707 11.5012 11.5012 12.7233 12.7233
k = 0.5000 0.1750 0.3649 ( 9324 PWs) bands (ev):
-39.0526 -39.0526 -39.0450 -39.0450 -7.1435 -7.1435 -7.1048 -7.1048
-7.0726 -7.0726 -7.0171 -7.0171 -6.3370 -6.3370 -6.2719 -6.2719
-6.2104 -6.2104 -6.1096 -6.1096 -6.0398 -6.0398 -5.9843 -5.9843
1.0446 1.0446 2.9699 2.9699 5.9441 5.9441 6.8445 6.8445
9.2755 9.2755 10.0119 10.0119 11.2821 11.2821 12.7486 12.7486
k = 0.5000 0.1837 0.3526 ( 9328 PWs) bands (ev):
-39.0527 -39.0527 -39.0449 -39.0449 -7.1434 -7.1434 -7.1035 -7.1035
-7.0734 -7.0734 -7.0181 -7.0181 -6.3376 -6.3376 -6.2735 -6.2735
-6.2104 -6.2104 -6.1045 -6.1045 -6.0400 -6.0400 -5.9876 -5.9876
1.0092 1.0092 2.9629 2.9629 6.0809 6.0809 6.9435 6.9435
9.2350 9.2350 9.9533 9.9533 11.0650 11.0650 12.7341 12.7341
k = 0.5000 0.1925 0.3402 ( 9336 PWs) bands (ev):
-39.0528 -39.0528 -39.0448 -39.0448 -7.1432 -7.1432 -7.1023 -7.1023
-7.0741 -7.0741 -7.0192 -7.0192 -6.3382 -6.3382 -6.2749 -6.2749
-6.2103 -6.2103 -6.0992 -6.0992 -6.0402 -6.0402 -5.9911 -5.9911
0.9766 0.9766 2.9551 2.9551 6.2227 6.2227 7.0413 7.0413
9.1952 9.1952 9.8952 9.8952 10.8513 10.8513 12.6884 12.6884
k = 0.5000 0.2012 0.3278 ( 9330 PWs) bands (ev):
-39.0529 -39.0529 -39.0446 -39.0446 -7.1431 -7.1431 -7.1012 -7.1012
-7.0747 -7.0747 -7.0203 -7.0203 -6.3387 -6.3387 -6.2762 -6.2762
-6.2102 -6.2102 -6.0940 -6.0940 -6.0404 -6.0404 -5.9948 -5.9948
0.9468 0.9468 2.9468 2.9468 6.3689 6.3689 7.1374 7.1374
9.1555 9.1555 9.8377 9.8377 10.6426 10.6426 12.6250 12.6250
k = 0.5000 0.2099 0.3155 ( 9334 PWs) bands (ev):
-39.0530 -39.0530 -39.0446 -39.0446 -7.1429 -7.1429 -7.1002 -7.1002
-7.0751 -7.0751 -7.0214 -7.0214 -6.3393 -6.3393 -6.2774 -6.2774
-6.2101 -6.2101 -6.0886 -6.0886 -6.0405 -6.0405 -5.9986 -5.9986
0.9198 0.9198 2.9385 2.9385 6.5186 6.5186 7.2310 7.2310
9.1147 9.1147 9.7813 9.7813 10.4407 10.4407 12.5545 12.5545
k = 0.5000 0.2187 0.3031 ( 9352 PWs) bands (ev):
-39.0531 -39.0531 -39.0445 -39.0445 -7.1427 -7.1427 -7.0993 -7.0993
-7.0754 -7.0754 -7.0225 -7.0225 -6.3398 -6.3398 -6.2785 -6.2785
-6.2100 -6.2100 -6.0833 -6.0833 -6.0407 -6.0407 -6.0026 -6.0026
0.8956 0.8956 2.9304 2.9304 6.6709 6.6709 7.3215 7.3215
9.0714 9.0714 9.7263 9.7263 10.2479 10.2479 12.4835 12.4835
k = 0.5000 0.2274 0.2907 ( 9352 PWs) bands (ev):
-39.0532 -39.0532 -39.0444 -39.0444 -7.1425 -7.1425 -7.0985 -7.0985
-7.0757 -7.0757 -7.0236 -7.0236 -6.3403 -6.3403 -6.2794 -6.2794
-6.2099 -6.2099 -6.0779 -6.0779 -6.0408 -6.0408 -6.0068 -6.0068
0.8742 0.8742 2.9228 2.9228 6.8243 6.8243 7.4081 7.4081
9.0232 9.0232 9.6735 9.6735 10.0674 10.0674 12.4159 12.4159
k = 0.5000 0.2362 0.2784 ( 9348 PWs) bands (ev):
-39.0533 -39.0533 -39.0443 -39.0443 -7.1423 -7.1423 -7.0979 -7.0979
-7.0758 -7.0758 -7.0246 -7.0246 -6.3407 -6.3407 -6.2802 -6.2802
-6.2098 -6.2098 -6.0726 -6.0726 -6.0409 -6.0409 -6.0111 -6.0111
0.8557 0.8557 2.9158 2.9158 6.9772 6.9772 7.4903 7.4903
8.9673 8.9673 9.6236 9.6236 9.9032 9.9032 12.3543 12.3543
k = 0.5000 0.2449 0.2660 ( 9344 PWs) bands (ev):
-39.0533 -39.0533 -39.0443 -39.0443 -7.1421 -7.1421 -7.0974 -7.0974
-7.0758 -7.0758 -7.0255 -7.0255 -6.3411 -6.3411 -6.2809 -6.2809
-6.2097 -6.2097 -6.0673 -6.0673 -6.0410 -6.0410 -6.0155 -6.0155
0.8400 0.8400 2.9096 2.9096 7.1266 7.1266 7.5678 7.5678
8.9003 8.9003 9.5777 9.5777 9.7605 9.7605 12.3003 12.3003
k = 0.5000 0.2537 0.2536 ( 9342 PWs) bands (ev):
-39.0534 -39.0534 -39.0442 -39.0442 -7.1420 -7.1420 -7.0970 -7.0970
-7.0757 -7.0757 -7.0263 -7.0263 -6.3414 -6.3414 -6.2815 -6.2815
-6.2097 -6.2097 -6.0620 -6.0620 -6.0411 -6.0411 -6.0201 -6.0201
0.8272 0.8272 2.9044 2.9044 7.2676 7.2676 7.6411 7.6411
8.8199 8.8199 9.5367 9.5367 9.6444 9.6444 12.2549 12.2549
k = 0.5000 0.2624 0.2412 ( 9338 PWs) bands (ev):
-39.0534 -39.0534 -39.0442 -39.0442 -7.1418 -7.1418 -7.0967 -7.0967
-7.0756 -7.0756 -7.0270 -7.0270 -6.3416 -6.3416 -6.2819 -6.2819
-6.2096 -6.2096 -6.0569 -6.0569 -6.0411 -6.0411 -6.0247 -6.0247
0.8172 0.8172 2.9002 2.9002 7.3921 7.3921 7.7121 7.7121
8.7282 8.7282 9.5014 9.5014 9.5584 9.5584 12.2188 12.2188
k = 0.5000 0.2712 0.2289 ( 9344 PWs) bands (ev):
-39.0535 -39.0535 -39.0442 -39.0442 -7.1417 -7.1417 -7.0965 -7.0965
-7.0756 -7.0756 -7.0275 -7.0275 -6.3418 -6.3418 -6.2822 -6.2822
-6.2096 -6.2096 -6.0520 -6.0520 -6.0410 -6.0410 -6.0293 -6.0293
0.8101 0.8101 2.8972 2.8972 7.4886 7.4886 7.7819 7.7819
8.6343 8.6343 9.4710 9.4710 9.5040 9.5040 12.1928 12.1928
k = 0.5000 0.2799 0.2165 ( 9360 PWs) bands (ev):
-39.0535 -39.0535 -39.0441 -39.0441 -7.1417 -7.1417 -7.0964 -7.0964
-7.0755 -7.0755 -7.0278 -7.0278 -6.3419 -6.3419 -6.2824 -6.2824
-6.2095 -6.2095 -6.0478 -6.0478 -6.0407 -6.0407 -6.0336 -6.0336
0.8058 0.8058 2.8954 2.8954 7.5474 7.5474 7.8420 7.8420
8.5576 8.5576 9.4475 9.4475 9.4779 9.4779 12.1770 12.1770
k = 0.5000 0.2887 0.2041 ( 9360 PWs) bands (ev):
-39.0535 -39.0535 -39.0441 -39.0441 -7.1417 -7.1417 -7.0963 -7.0963
-7.0755 -7.0755 -7.0279 -7.0279 -6.3420 -6.3420 -6.2825 -6.2825
-6.2095 -6.2095 -6.0459 -6.0459 -6.0400 -6.0400 -6.0361 -6.0361
0.8043 0.8043 2.8948 2.8948 7.5667 7.5667 7.8678 7.8678
8.5264 8.5264 9.4386 9.4386 9.4705 9.4705 12.1717 12.1717
k = 0.5000 0.2887 0.2041 ( 9360 PWs) bands (ev):
-39.0535 -39.0535 -39.0441 -39.0441 -7.1417 -7.1417 -7.0963 -7.0963
-7.0755 -7.0755 -7.0279 -7.0279 -6.3420 -6.3420 -6.2825 -6.2825
-6.2095 -6.2095 -6.0459 -6.0459 -6.0400 -6.0400 -6.0361 -6.0361
0.8043 0.8043 2.8948 2.8948 7.5667 7.5667 7.8678 7.8678
8.5264 8.5264 9.4386 9.4386 9.4705 9.4705 12.1717 12.1717
k = 0.4957 0.2862 0.2182 ( 9360 PWs) bands (ev):
-39.0535 -39.0535 -39.0441 -39.0441 -7.1417 -7.1417 -7.0964 -7.0964
-7.0755 -7.0755 -7.0278 -7.0278 -6.3419 -6.3419 -6.2824 -6.2824
-6.2095 -6.2095 -6.0478 -6.0478 -6.0407 -6.0407 -6.0336 -6.0336
0.8057 0.8057 2.8954 2.8954 7.5480 7.5480 7.8427 7.8427
8.5567 8.5567 9.4472 9.4472 9.4777 9.4777 12.1769 12.1769
k = 0.4914 0.2837 0.2323 ( 9352 PWs) bands (ev):
-39.0535 -39.0535 -39.0442 -39.0442 -7.1417 -7.1417 -7.0965 -7.0965
-7.0756 -7.0756 -7.0275 -7.0275 -6.3418 -6.3418 -6.2822 -6.2822
-6.2096 -6.2096 -6.0519 -6.0519 -6.0410 -6.0410 -6.0294 -6.0294
0.8099 0.8099 2.8971 2.8971 7.4908 7.4908 7.7840 7.7840
8.6316 8.6316 9.4715 9.4715 9.5016 9.5016 12.1922 12.1922
k = 0.4871 0.2812 0.2464 ( 9342 PWs) bands (ev):
-39.0534 -39.0534 -39.0442 -39.0442 -7.1418 -7.1418 -7.0967 -7.0967
-7.0756 -7.0756 -7.0270 -7.0270 -6.3417 -6.3417 -6.2819 -6.2819
-6.2096 -6.2096 -6.0567 -6.0567 -6.0411 -6.0411 -6.0249 -6.0249
0.8168 0.8168 2.9001 2.9001 7.3966 7.3966 7.7160 7.7160
8.7228 8.7228 9.5101 9.5101 9.5461 9.5461 12.2175 12.2175
k = 0.4828 0.2787 0.2604 ( 9338 PWs) bands (ev):
-39.0534 -39.0534 -39.0442 -39.0442 -7.1420 -7.1420 -7.0969 -7.0969
-7.0757 -7.0757 -7.0263 -7.0263 -6.3414 -6.3414 -6.2815 -6.2815
-6.2096 -6.2096 -6.0617 -6.0617 -6.0411 -6.0411 -6.0203 -6.0203
0.8265 0.8265 2.9041 2.9041 7.2740 7.2740 7.6482 7.6482
8.8091 8.8091 9.5670 9.5670 9.6103 9.6103 12.2525 12.2525
k = 0.4784 0.2762 0.2745 ( 9334 PWs) bands (ev):
-39.0533 -39.0533 -39.0443 -39.0443 -7.1421 -7.1421 -7.0973 -7.0973
-7.0758 -7.0758 -7.0256 -7.0256 -6.3411 -6.3411 -6.2809 -6.2809
-6.2097 -6.2097 -6.0669 -6.0669 -6.0410 -6.0410 -6.0159 -6.0159
0.8390 0.8390 2.9092 2.9092 7.1340 7.1340 7.5802 7.5802
8.8779 8.8779 9.6473 9.6473 9.6916 9.6916 12.2968 12.2968
k = 0.4741 0.2737 0.2886 ( 9334 PWs) bands (ev):
-39.0533 -39.0533 -39.0443 -39.0443 -7.1423 -7.1423 -7.0978 -7.0978
-7.0758 -7.0758 -7.0247 -7.0247 -6.3407 -6.3407 -6.2803 -6.2803
-6.2098 -6.2098 -6.0721 -6.0721 -6.0409 -6.0409 -6.0115 -6.0115
0.8542 0.8542 2.9152 2.9152 6.9846 6.9846 7.5105 7.5105
8.9244 8.9244 9.7490 9.7490 9.7900 9.7900 12.3497 12.3497
k = 0.4698 0.2713 0.3027 ( 9339 PWs) bands (ev):
-39.0532 -39.0532 -39.0444 -39.0444 -7.1425 -7.1425 -7.0984 -7.0984
-7.0757 -7.0757 -7.0237 -7.0237 -6.3403 -6.3403 -6.2795 -6.2795
-6.2099 -6.2099 -6.0774 -6.0774 -6.0408 -6.0408 -6.0073 -6.0073
0.8722 0.8722 2.9220 2.9220 6.8307 6.8307 7.4390 7.4390
8.9504 8.9504 9.8619 9.8619 9.9098 9.9098 12.4103 12.4103
k = 0.4655 0.2688 0.3167 ( 9334 PWs) bands (ev):
-39.0531 -39.0531 -39.0445 -39.0445 -7.1427 -7.1427 -7.0992 -7.0992
-7.0755 -7.0755 -7.0226 -7.0226 -6.3399 -6.3399 -6.2786 -6.2786
-6.2100 -6.2100 -6.0827 -6.0827 -6.0407 -6.0407 -6.0031 -6.0031
0.8929 0.8929 2.9295 2.9295 6.6752 6.6752 7.3657 7.3657
8.9606 8.9606 9.9784 9.9784 10.0509 10.0509 12.4774 12.4774
k = 0.4612 0.2663 0.3308 ( 9336 PWs) bands (ev):
-39.0531 -39.0531 -39.0445 -39.0445 -7.1429 -7.1429 -7.1000 -7.1000
-7.0752 -7.0752 -7.0215 -7.0215 -6.3394 -6.3394 -6.2775 -6.2775
-6.2101 -6.2101 -6.0879 -6.0879 -6.0405 -6.0405 -5.9992 -5.9992
0.9164 0.9164 2.9374 2.9374 6.5199 6.5199 7.2914 7.2914
8.9595 8.9595 10.0995 10.0995 10.2055 10.2055 12.5491 12.5491
k = 0.4569 0.2638 0.3449 ( 9337 PWs) bands (ev):
-39.0530 -39.0530 -39.0446 -39.0446 -7.1430 -7.1430 -7.1010 -7.1010
-7.0748 -7.0748 -7.0204 -7.0204 -6.3388 -6.3388 -6.2764 -6.2764
-6.2102 -6.2102 -6.0932 -6.0932 -6.0403 -6.0403 -5.9954 -5.9954
0.9426 0.9426 2.9455 2.9455 6.3662 6.3662 7.2167 7.2167
8.9506 8.9506 10.2261 10.2261 10.3674 10.3674 12.6220 12.6220
k = 0.4526 0.2613 0.3590 ( 9333 PWs) bands (ev):
-39.0529 -39.0529 -39.0447 -39.0447 -7.1432 -7.1432 -7.1020 -7.1020
-7.0743 -7.0743 -7.0194 -7.0194 -6.3383 -6.3383 -6.2751 -6.2751
-6.2103 -6.2103 -6.0984 -6.0984 -6.0401 -6.0401 -5.9918 -5.9918
0.9716 0.9716 2.9536 2.9536 6.2151 6.2151 7.1420 7.1420
8.9362 8.9362 10.3580 10.3580 10.5326 10.5326 12.6905 12.6905
k = 0.4483 0.2588 0.3731 ( 9331 PWs) bands (ev):
-39.0527 -39.0527 -39.0448 -39.0448 -7.1434 -7.1434 -7.1031 -7.1031
-7.0737 -7.0737 -7.0183 -7.0183 -6.3377 -6.3377 -6.2737 -6.2737
-6.2104 -6.2104 -6.1035 -6.1035 -6.0399 -6.0399 -5.9883 -5.9883
1.0032 1.0032 2.9613 2.9613 6.0674 6.0674 7.0679 7.0679
8.9181 8.9181 10.4948 10.4948 10.6983 10.6983 12.7444 12.7444
k = 0.4440 0.2563 0.3871 ( 9336 PWs) bands (ev):
-39.0526 -39.0526 -39.0450 -39.0450 -7.1435 -7.1435 -7.1042 -7.1042
-7.0731 -7.0731 -7.0173 -7.0173 -6.3371 -6.3371 -6.2723 -6.2723
-6.2105 -6.2105 -6.1086 -6.1086 -6.0397 -6.0397 -5.9851 -5.9851
1.0376 1.0376 2.9682 2.9682 5.9239 5.9239 6.9949 6.9949
8.8975 8.8975 10.6362 10.6362 10.8618 10.8618 12.7689 12.7689
k = 0.4397 0.2538 0.4012 ( 9337 PWs) bands (ev):
-39.0525 -39.0525 -39.0451 -39.0451 -7.1436 -7.1436 -7.1054 -7.1054
-7.0723 -7.0723 -7.0164 -7.0164 -6.3365 -6.3365 -6.2707 -6.2707
-6.2106 -6.2106 -6.1136 -6.1136 -6.0394 -6.0394 -5.9821 -5.9821
1.0745 1.0745 2.9739 2.9739 5.7855 5.7855 6.9232 6.9232
8.8752 8.8752 10.7817 10.7817 11.0204 11.0204 12.7535 12.7535
k = 0.4353 0.2513 0.4153 ( 9331 PWs) bands (ev):
-39.0524 -39.0524 -39.0452 -39.0452 -7.1437 -7.1437 -7.1066 -7.1066
-7.0715 -7.0715 -7.0155 -7.0155 -6.3359 -6.3359 -6.2690 -6.2690
-6.2107 -6.2107 -6.1184 -6.1184 -6.0392 -6.0392 -5.9792 -5.9792
1.1141 1.1141 2.9777 2.9777 5.6528 5.6528 6.8532 6.8532
8.8518 8.8518 10.9310 10.9310 11.1704 11.1704 12.7050 12.7050
k = 0.4310 0.2489 0.4294 ( 9331 PWs) bands (ev):
-39.0522 -39.0522 -39.0454 -39.0454 -7.1437 -7.1437 -7.1078 -7.1078
-7.0707 -7.0707 -7.0148 -7.0148 -6.3353 -6.3353 -6.2673 -6.2673
-6.2107 -6.2107 -6.1232 -6.1232 -6.0389 -6.0389 -5.9766 -5.9766
1.1563 1.1563 2.9792 2.9792 5.5268 5.5268 6.7851 6.7851
8.8280 8.8280 11.0834 11.0834 11.3069 11.3069 12.6428 12.6428
k = 0.4267 0.2464 0.4434 ( 9333 PWs) bands (ev):
-39.0521 -39.0521 -39.0455 -39.0455 -7.1437 -7.1437 -7.1089 -7.1089
-7.0699 -7.0699 -7.0141 -7.0141 -6.3347 -6.3347 -6.2655 -6.2655
-6.2108 -6.2108 -6.1277 -6.1277 -6.0386 -6.0386 -5.9741 -5.9741
1.2009 1.2009 2.9776 2.9776 5.4083 5.4083 6.7190 6.7190
8.8041 8.8041 11.2382 11.2382 11.4224 11.4224 12.5871 12.5871
k = 0.4224 0.2439 0.4575 ( 9343 PWs) bands (ev):
-39.0519 -39.0519 -39.0457 -39.0457 -7.1436 -7.1436 -7.1101 -7.1101
-7.0690 -7.0690 -7.0135 -7.0135 -6.3341 -6.3341 -6.2637 -6.2637
-6.2108 -6.2108 -6.1322 -6.1322 -6.0382 -6.0382 -5.9719 -5.9719
1.2480 1.2480 2.9722 2.9722 5.2983 5.2983 6.6553 6.6553
8.7803 8.7803 11.3913 11.3913 11.5098 11.5098 12.5559 12.5559
k = 0.4181 0.2414 0.4716 ( 9342 PWs) bands (ev):
-39.0517 -39.0517 -39.0459 -39.0459 -7.1435 -7.1435 -7.1112 -7.1112
-7.0681 -7.0681 -7.0131 -7.0131 -6.3335 -6.3335 -6.2619 -6.2619
-6.2108 -6.2108 -6.1364 -6.1364 -6.0379 -6.0379 -5.9700 -5.9700
1.2974 1.2974 2.9623 2.9623 5.1976 5.1976 6.5940 6.5940
8.7571 8.7571 11.5049 11.5049 11.5961 11.5961 12.5635 12.5635
k = 0.4138 0.2389 0.4857 ( 9340 PWs) bands (ev):
-39.0516 -39.0516 -39.0460 -39.0460 -7.1434 -7.1434 -7.1122 -7.1122
-7.0672 -7.0672 -7.0128 -7.0128 -6.3330 -6.3330 -6.2601 -6.2601
-6.2107 -6.2107 -6.1404 -6.1404 -6.0375 -6.0375 -5.9682 -5.9682
1.3489 1.3489 2.9471 2.9471 5.1072 5.1072 6.5352 6.5352
8.7345 8.7345 11.5129 11.5129 11.7443 11.7443 12.6150 12.6150
k = 0.4095 0.2364 0.4998 ( 9334 PWs) bands (ev):
-39.0514 -39.0514 -39.0462 -39.0462 -7.1432 -7.1432 -7.1132 -7.1132
-7.0664 -7.0664 -7.0126 -7.0126 -6.3324 -6.3324 -6.2584 -6.2584
-6.2106 -6.2106 -6.1442 -6.1442 -6.0371 -6.0371 -5.9667 -5.9667
1.4024 1.4024 2.9261 2.9261 5.0280 5.0280 6.4790 6.4790
8.7129 8.7129 11.4676 11.4676 11.9096 11.9096 12.7038 12.7038
k = 0.4052 0.2339 0.5138 ( 9330 PWs) bands (ev):
-39.0512 -39.0512 -39.0464 -39.0464 -7.1430 -7.1430 -7.1141 -7.1141
-7.0655 -7.0655 -7.0125 -7.0125 -6.3319 -6.3319 -6.2568 -6.2568
-6.2104 -6.2104 -6.1477 -6.1477 -6.0367 -6.0367 -5.9653 -5.9653
1.4575 1.4575 2.8990 2.8990 4.9607 4.9607 6.4257 6.4257
8.6923 8.6923 11.3932 11.3932 12.0800 12.0800 12.8182 12.8182
k = 0.4009 0.2314 0.5279 ( 9328 PWs) bands (ev):
-39.0510 -39.0510 -39.0465 -39.0465 -7.1427 -7.1427 -7.1149 -7.1149
-7.0647 -7.0647 -7.0125 -7.0125 -6.3314 -6.3314 -6.2555 -6.2555
-6.2101 -6.2101 -6.1509 -6.1509 -6.0363 -6.0363 -5.9643 -5.9643
1.5139 1.5139 2.8656 2.8656 4.9056 4.9056 6.3751 6.3751
8.6728 8.6728 11.3015 11.3015 12.2535 12.2535 12.9481 12.9481
k = 0.3966 0.2289 0.5420 ( 9328 PWs) bands (ev):
-39.0509 -39.0509 -39.0467 -39.0467 -7.1424 -7.1424 -7.1157 -7.1157
-7.0640 -7.0640 -7.0127 -7.0127 -6.3308 -6.3308 -6.2543 -6.2543
-6.2098 -6.2098 -6.1538 -6.1538 -6.0358 -6.0358 -5.9634 -5.9634
1.5710 1.5710 2.8265 2.8265 4.8630 4.8630 6.3275 6.3275
8.6547 8.6547 11.1999 11.1999 12.4297 12.4297 13.0861 13.0861
k = 0.3922 0.2265 0.5561 ( 9316 PWs) bands (ev):
-39.0507 -39.0507 -39.0469 -39.0469 -7.1420 -7.1420 -7.1164 -7.1164
-7.0632 -7.0632 -7.0129 -7.0129 -6.3303 -6.3303 -6.2535 -6.2535
-6.2093 -6.2093 -6.1563 -6.1563 -6.0354 -6.0354 -5.9628 -5.9628
1.6280 1.6280 2.7826 2.7826 4.8327 4.8327 6.2829 6.2829
8.6380 8.6380 11.0926 11.0926 12.6079 12.6079 13.2262 13.2262
k = 0.3879 0.2240 0.5701 ( 9313 PWs) bands (ev):
-39.0505 -39.0505 -39.0470 -39.0470 -7.1416 -7.1416 -7.1170 -7.1170
-7.0625 -7.0625 -7.0133 -7.0133 -6.3298 -6.3298 -6.2530 -6.2530
-6.2087 -6.2087 -6.1584 -6.1584 -6.0349 -6.0349 -5.9624 -5.9624
1.6835 1.6835 2.7357 2.7357 4.8143 4.8143 6.2413 6.2413
8.6228 8.6228 10.9825 10.9825 12.7874 12.7874 13.3583 13.3583
k = 0.3836 0.2215 0.5842 ( 9325 PWs) bands (ev):
-39.0504 -39.0504 -39.0472 -39.0472 -7.1412 -7.1412 -7.1175 -7.1175
-7.0619 -7.0619 -7.0137 -7.0137 -6.3293 -6.3293 -6.2529 -6.2529
-6.2081 -6.2081 -6.1599 -6.1599 -6.0345 -6.0345 -5.9622 -5.9622
1.7358 1.7358 2.6883 2.6883 4.8071 4.8071 6.2028 6.2028
8.6092 8.6092 10.8712 10.8712 12.9664 12.9664 13.4312 13.4312
k = 0.3793 0.2190 0.5983 ( 9325 PWs) bands (ev):
-39.0503 -39.0503 -39.0473 -39.0473 -7.1408 -7.1408 -7.1180 -7.1180
-7.0614 -7.0614 -7.0142 -7.0142 -6.3287 -6.3287 -6.2531 -6.2531
-6.2074 -6.2074 -6.1610 -6.1610 -6.0340 -6.0340 -5.9622 -5.9622
1.7820 1.7820 2.6440 2.6440 4.8103 4.8103 6.1674 6.1674
8.5972 8.5972 10.7598 10.7598 13.1387 13.1387 13.4262 13.4262
k = 0.3750 0.2165 0.6124 ( 9330 PWs) bands (ev):
-39.0501 -39.0501 -39.0474 -39.0474 -7.1403 -7.1403 -7.1183 -7.1183
-7.0609 -7.0609 -7.0149 -7.0149 -6.3282 -6.3282 -6.2537 -6.2537
-6.2067 -6.2067 -6.1615 -6.1615 -6.0335 -6.0335 -5.9625 -5.9625
1.8180 1.8180 2.6077 2.6077 4.8229 4.8229 6.1352 6.1352
8.5869 8.5869 10.6492 10.6492 13.2692 13.2692 13.4505 13.4505
k = 0.6250-0.0722 0.4082 ( 9330 PWs) bands (ev):
-39.0501 -39.0501 -39.0474 -39.0474 -7.1403 -7.1403 -7.1183 -7.1183
-7.0609 -7.0609 -7.0149 -7.0149 -6.3282 -6.3282 -6.2537 -6.2537
-6.2067 -6.2067 -6.1615 -6.1615 -6.0335 -6.0335 -5.9625 -5.9625
1.8180 1.8180 2.6077 2.6077 4.8229 4.8229 6.1352 6.1352
8.5869 8.5869 10.6492 10.6492 13.2692 13.2692 13.4505 13.4505
k = 0.6176-0.0849 0.4082 ( 9322 PWs) bands (ev):
-39.0500 -39.0500 -39.0476 -39.0476 -7.1396 -7.1396 -7.1188 -7.1188
-7.0601 -7.0601 -7.0160 -7.0160 -6.3271 -6.3271 -6.2554 -6.2554
-6.2055 -6.2055 -6.1618 -6.1618 -6.0326 -6.0326 -5.9632 -5.9632
1.8660 1.8660 2.5576 2.5576 4.8556 4.8556 6.0845 6.0845
8.5713 8.5713 10.4620 10.4620 13.4044 13.4044 13.5789 13.5789
k = 0.6103-0.0976 0.4082 ( 9324 PWs) bands (ev):
-39.0499 -39.0499 -39.0477 -39.0477 -7.1387 -7.1387 -7.1192 -7.1192
-7.0594 -7.0594 -7.0173 -7.0173 -6.3260 -6.3260 -6.2574 -6.2574
-6.2039 -6.2039 -6.1621 -6.1621 -6.0316 -6.0316 -5.9641 -5.9641
1.9100 1.9100 2.5106 2.5106 4.8952 4.8952 6.0367 6.0367
8.5566 8.5566 10.2763 10.2763 13.5405 13.5405 13.7081 13.7081
k = 0.6029-0.1104 0.4082 ( 9318 PWs) bands (ev):
-39.0497 -39.0497 -39.0478 -39.0478 -7.1378 -7.1378 -7.1197 -7.1197
-7.0586 -7.0586 -7.0187 -7.0187 -6.3249 -6.3249 -6.2598 -6.2598
-6.2020 -6.2020 -6.1624 -6.1624 -6.0304 -6.0304 -5.9653 -5.9653
1.9498 1.9498 2.4666 2.4666 4.9413 4.9413 5.9918 5.9918
8.5428 8.5428 10.0932 10.0932 13.6772 13.6772 13.8378 13.8378
k = 0.5956-0.1231 0.4082 ( 9316 PWs) bands (ev):
-39.0496 -39.0496 -39.0480 -39.0480 -7.1369 -7.1369 -7.1201 -7.1201
-7.0578 -7.0578 -7.0202 -7.0202 -6.3236 -6.3236 -6.2624 -6.2624
-6.1999 -6.1999 -6.1626 -6.1626 -6.0291 -6.0291 -5.9666 -5.9666
1.9856 1.9856 2.4258 2.4258 4.9936 4.9936 5.9499 5.9499
8.5299 8.5299 9.9135 9.9135 13.8142 13.8142 13.9675 13.9675
k = 0.5882-0.1358 0.4082 ( 9314 PWs) bands (ev):
-39.0495 -39.0495 -39.0481 -39.0481 -7.1359 -7.1359 -7.1205 -7.1205
-7.0570 -7.0570 -7.0218 -7.0218 -6.3222 -6.3222 -6.2652 -6.2652
-6.1977 -6.1977 -6.1630 -6.1630 -6.0276 -6.0276 -5.9682 -5.9682
2.0174 2.0174 2.3880 2.3880 5.0512 5.0512 5.9110 5.9110
8.5180 8.5180 9.7383 9.7383 13.9510 13.9510 14.0965 14.0965
k = 0.5809-0.1486 0.4082 ( 9314 PWs) bands (ev):
-39.0494 -39.0494 -39.0482 -39.0482 -7.1349 -7.1349 -7.1208 -7.1208
-7.0562 -7.0562 -7.0235 -7.0235 -6.3207 -6.3207 -6.2680 -6.2680
-6.1954 -6.1954 -6.1633 -6.1633 -6.0259 -6.0259 -5.9700 -5.9700
2.0455 2.0455 2.3532 2.3532 5.1135 5.1135 5.8751 5.8751
8.5070 8.5070 9.5685 9.5685 14.0869 14.0869 14.2239 14.2239
k = 0.5735-0.1613 0.4082 ( 9340 PWs) bands (ev):
-39.0493 -39.0493 -39.0483 -39.0483 -7.1338 -7.1338 -7.1212 -7.1212
-7.0553 -7.0553 -7.0253 -7.0253 -6.3192 -6.3192 -6.2710 -6.2710
-6.1930 -6.1930 -6.1637 -6.1637 -6.0240 -6.0240 -5.9720 -5.9720
2.0700 2.0700 2.3215 2.3215 5.1794 5.1794 5.8422 5.8422
8.4970 8.4970 9.4050 9.4050 14.2211 14.2211 14.3488 14.3488
k = 0.5662-0.1741 0.4082 ( 9326 PWs) bands (ev):
-39.0492 -39.0492 -39.0484 -39.0484 -7.1328 -7.1328 -7.1215 -7.1215
-7.0544 -7.0544 -7.0271 -7.0271 -6.3175 -6.3175 -6.2739 -6.2739
-6.1907 -6.1907 -6.1642 -6.1642 -6.0220 -6.0220 -5.9741 -5.9741
2.0912 2.0912 2.2928 2.2928 5.2477 5.2477 5.8124 5.8124
8.4879 8.4879 9.2489 9.2489 14.3527 14.3527 14.4699 14.4699
k = 0.5588-0.1868 0.4082 ( 9320 PWs) bands (ev):
-39.0491 -39.0491 -39.0485 -39.0485 -7.1317 -7.1317 -7.1218 -7.1218
-7.0535 -7.0535 -7.0290 -7.0290 -6.3158 -6.3158 -6.2769 -6.2769
-6.1884 -6.1884 -6.1648 -6.1648 -6.0199 -6.0199 -5.9764 -5.9764
2.1093 2.1093 2.2672 2.2672 5.3171 5.3171 5.7857 5.7857
8.4797 8.4797 9.1016 9.1016 14.4804 14.4804 14.5858 14.5858
k = 0.5515-0.1995 0.4082 ( 9324 PWs) bands (ev):
-39.0490 -39.0490 -39.0485 -39.0485 -7.1307 -7.1307 -7.1222 -7.1222
-7.0525 -7.0525 -7.0309 -7.0309 -6.3140 -6.3140 -6.2798 -6.2798
-6.1862 -6.1862 -6.1655 -6.1655 -6.0175 -6.0175 -5.9789 -5.9789
2.1245 2.1245 2.2446 2.2446 5.3859 5.3859 5.7621 5.7621
8.4725 8.4725 8.9645 8.9645 14.6026 14.6026 14.6948 14.6948
k = 0.5441-0.2123 0.4082 ( 9328 PWs) bands (ev):
-39.0490 -39.0490 -39.0486 -39.0486 -7.1297 -7.1297 -7.1225 -7.1225
-7.0514 -7.0514 -7.0328 -7.0328 -6.3121 -6.3121 -6.2827 -6.2827
-6.1841 -6.1841 -6.1663 -6.1663 -6.0151 -6.0151 -5.9814 -5.9814
2.1372 2.1372 2.2250 2.2250 5.4524 5.4524 5.7416 5.7416
8.4663 8.4663 8.8393 8.8393 14.7171 14.7171 14.7951 14.7951
k = 0.5368-0.2250 0.4082 ( 9324 PWs) bands (ev):
-39.0489 -39.0489 -39.0487 -39.0487 -7.1288 -7.1288 -7.1229 -7.1229
-7.0503 -7.0503 -7.0346 -7.0346 -6.3101 -6.3101 -6.2856 -6.2856
-6.1820 -6.1820 -6.1671 -6.1671 -6.0125 -6.0125 -5.9841 -5.9841
2.1475 2.1475 2.2085 2.2085 5.5144 5.5144 5.7242 5.7242
8.4610 8.4610 8.7278 8.7278 14.8217 14.8217 14.8847 14.8847
k = 0.5294-0.2377 0.4082 ( 9340 PWs) bands (ev):
-39.0489 -39.0489 -39.0487 -39.0487 -7.1279 -7.1279 -7.1232 -7.1232
-7.0491 -7.0491 -7.0365 -7.0365 -6.3080 -6.3080 -6.2883 -6.2883
-6.1800 -6.1800 -6.1681 -6.1681 -6.0099 -6.0099 -5.9869 -5.9869
2.1557 2.1557 2.1949 2.1949 5.5698 5.5698 5.7100 5.7100
8.4567 8.4567 8.6323 8.6323 14.9134 14.9134 14.9615 14.9615
k = 0.5221-0.2505 0.4082 ( 9332 PWs) bands (ev):
-39.0488 -39.0488 -39.0487 -39.0487 -7.1271 -7.1271 -7.1236 -7.1236
-7.0478 -7.0478 -7.0383 -7.0383 -6.3058 -6.3058 -6.2911 -6.2911
-6.1782 -6.1782 -6.1692 -6.1692 -6.0071 -6.0071 -5.9897 -5.9897
2.1618 2.1618 2.1844 2.1844 5.6162 5.6162 5.6989 5.6989
8.4534 8.4534 8.5548 8.5548 14.9893 14.9893 15.0234 15.0234
k = 0.5147-0.2632 0.4082 ( 9336 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1264 -7.1264 -7.1241 -7.1241
-7.0464 -7.0464 -7.0401 -7.0401 -6.3035 -6.3035 -6.2937 -6.2937
-6.1764 -6.1764 -6.1704 -6.1704 -6.0043 -6.0043 -5.9926 -5.9926
2.1662 2.1662 2.1769 2.1769 5.6513 5.6513 5.6909 5.6909
8.4510 8.4510 8.4975 8.4975 15.0469 15.0469 15.0683 15.0683
k = 0.5074-0.2759 0.4082 ( 9352 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1257 -7.1257 -7.1246 -7.1246
-7.0449 -7.0449 -7.0418 -7.0418 -6.3012 -6.3012 -6.2963 -6.2963
-6.1747 -6.1747 -6.1717 -6.1717 -6.0014 -6.0014 -5.9955 -5.9955
2.1688 2.1688 2.1723 2.1723 5.6734 5.6734 5.6860 5.6860
8.4496 8.4496 8.4623 8.4623 15.0840 15.0840 15.0943 15.0943
k = 0.5000-0.2887 0.4082 ( 9336 PWs) bands (ev):
-39.0488 -39.0488 -39.0488 -39.0488 -7.1251 -7.1251 -7.1251 -7.1251
-7.0434 -7.0434 -7.0434 -7.0434 -6.2988 -6.2988 -6.2988 -6.2988
-6.1732 -6.1732 -6.1732 -6.1732 -5.9985 -5.9985 -5.9985 -5.9985
2.1702 2.1702 2.1702 2.1702 5.6826 5.6826 5.6826 5.6826
8.4498 8.4498 8.4498 8.4498 15.0999 15.0999 15.0999 15.0999
Writing output data file LiIn.save
init_run : 0.19s CPU 0.30s WALL ( 1 calls)
electrons : 156.90s CPU 158.86s WALL ( 1 calls)
Called by init_run:
wfcinit : 0.00s CPU 0.01s WALL ( 1 calls)
potinit : 0.01s CPU 0.04s WALL ( 1 calls)
Called by electrons:
c_bands : 156.89s CPU 158.85s WALL ( 1 calls)
v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls)
v_h : 0.00s CPU 0.00s WALL ( 1 calls)
v_xc : 0.00s CPU 0.00s WALL ( 1 calls)
newd : 0.04s CPU 0.06s WALL ( 1 calls)
Called by c_bands:
init_us_2 : 0.08s CPU 0.10s WALL ( 314 calls)
cegterg : 138.48s CPU 139.79s WALL ( 350 calls)
Called by sum_band:
Called by *egterg:
h_psi : 104.77s CPU 106.22s WALL ( 5899 calls)
s_psi : 3.88s CPU 3.90s WALL ( 5899 calls)
g_psi : 0.37s CPU 0.34s WALL ( 5235 calls)
cdiaghg : 26.86s CPU 27.22s WALL ( 5549 calls)
cegterg:over : 6.18s CPU 5.96s WALL ( 5235 calls)
cegterg:upda : 6.08s CPU 6.07s WALL ( 5235 calls)
cegterg:last : 2.90s CPU 2.90s WALL ( 978 calls)
cdiaghg:chol : 1.72s CPU 1.61s WALL ( 5549 calls)
cdiaghg:inve : 0.78s CPU 0.83s WALL ( 5549 calls)
cdiaghg:para : 1.54s CPU 1.58s WALL ( 11098 calls)
Called by h_psi:
h_psi:vloc : 97.17s CPU 98.52s WALL ( 5899 calls)
h_psi:vnl : 7.25s CPU 7.37s WALL ( 5899 calls)
add_vuspsi : 3.45s CPU 3.49s WALL ( 5899 calls)
General routines
calbec : 3.79s CPU 3.87s WALL ( 5899 calls)
fft : 0.00s CPU 0.01s WALL ( 15 calls)
fftw : 92.31s CPU 93.48s WALL ( 528044 calls)
davcio : 0.25s CPU 0.33s WALL ( 628 calls)
Parallel routines
fft_scatter : 30.12s CPU 30.52s WALL ( 528059 calls)
PWSCF : 2m56.51s CPU 3m11.53s WALL
This run was terminated on: 19:36:18 5Jan2017
=------------------------------------------------------------------------------=
JOB DONE.
=------------------------------------------------------------------------------=