Program PWSCF v.5.1.1 starts on 28Oct2015 at 3:24:14
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 48 processors
R & G space division: proc/nbgrp/npool/nimage = 48
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:
./SnxHgSe2x2.save/
file Hg.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S renormalized
file Sn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 4D 4D renormalized
Subspace diagonalization in iterative solution of the eigenvalue problem:
a serial algorithm will be used
Parallelization info
--------------------
sticks: dense smooth PW G-vecs: dense smooth PW
Min 116 53 15 3885 1208 181
Max 117 54 16 3888 1229 183
Sum 5585 2587 727 186527 58469 8749
bravais-lattice index = 14
lattice parameter (alat) = 13.3728 a.u.
unit-cell volume = 1301.4167 (a.u.)^3
number of atoms/cell = 7
number of atomic types = 3
number of electrons = 62.00
number of Kohn-Sham states= 74
kinetic-energy cutoff = 48.0000 Ry
charge density cutoff = 416.0000 Ry
Exchange-correlation = PBE ( 1 4 3 4 0 0)
Non magnetic calculation with spin-orbit
celldm(1)= 13.372789 celldm(2)= 1.000000 celldm(3)= 1.000000
celldm(4)= -0.666782 celldm(5)= -0.666782 celldm(6)= 0.333564
crystal axes: (cart. coord. in units of alat)
a(1) = ( 1.000000 0.000000 0.000000 )
a(2) = ( 0.333564 0.942727 0.000000 )
a(3) = ( -0.666782 -0.471364 0.577250 )
reciprocal axes: (cart. coord. in units 2 pi/alat)
b(1) = ( 1.000000 -0.353829 0.866175 )
b(2) = ( 0.000000 1.060752 0.866175 )
b(3) = ( 0.000000 0.000000 1.732351 )
PseudoPot. # 1 for Hg read from file:
/home/autes/Pseudo/Hg.rel-pbe-n-rrkjus_psl.1.0.0.UPF
MD5 check sum: a7fd98bfb2640362c6e2ed76594f1960
Pseudo is Ultrasoft + core correction, Zval = 12.0
Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656
Using radial grid of 1279 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 Se read from file:
/home/autes/Pseudo/Se_MT_PBE.UPF
MD5 check sum: 8b5aa0a73ac3f20b8f2ba32420215307
Pseudo is Norm-conserving, Zval = 6.0
Generated using "atomic" code by A. Dal Corso (espresso distribution)
Using radial grid of 1211 points, 3 beta functions with:
l(1) = 0
l(2) = 1
l(3) = 1
PseudoPot. # 3 for Sn read from file:
/home/autes/Pseudo/Sn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF
MD5 check sum: 9499e19b89e678f7f9f46ad7de03aa82
Pseudo is Ultrasoft + core correction, Zval = 14.0
Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656
Using radial grid of 1243 points, 10 beta functions with:
l(1) = 0
l(2) = 0
l(3) = 1
l(4) = 1
l(5) = 1
l(6) = 1
l(7) = 2
l(8) = 2
l(9) = 2
l(10) = 2
Q(r) pseudized with 0 coefficients
atomic species valence mass pseudopotential
Hg 12.00 200.59000 Hg( 1.00)
Se 6.00 78.96000 Se( 1.00)
Sn 14.00 118.71000 Sn( 1.00)
No symmetry found
s frac. trans.
isym = 1 identity
cryst. s( 1) = ( 1 0 0 )
( 0 1 0 )
( 0 0 1 )
cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 )
( 0.0000000 1.0000000 0.0000000 )
( 0.0000000 0.0000000 1.0000000 )
double point group C_1 (1)
there are 2 classes and 1 irreducible representations
the character table:
E -E
G_2 1.00 -1.00
the symmetry operations in each class:
E 1
-E -1
Cartesian axes
number of k points= 268 Fermi-Dirac smearing, width (Ry)= 0.0010
cart. coord. in units 2pi/alat
k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037313
k( 2) = ( 0.0000000 0.0000000 0.0222096), wk = 0.0037313
k( 3) = ( 0.0000000 0.0000000 0.0444193), wk = 0.0037313
k( 4) = ( 0.0000000 0.0000000 0.0666289), wk = 0.0037313
k( 5) = ( 0.0000000 0.0000000 0.0888385), wk = 0.0037313
k( 6) = ( 0.0000000 0.0000000 0.1110481), wk = 0.0037313
k( 7) = ( 0.0000000 0.0000000 0.1332577), wk = 0.0037313
k( 8) = ( 0.0000000 0.0000000 0.1554674), wk = 0.0037313
k( 9) = ( 0.0000000 0.0000000 0.1776770), wk = 0.0037313
k( 10) = ( 0.0000000 0.0000000 0.1998866), wk = 0.0037313
k( 11) = ( 0.0000000 0.0000000 0.2220962), wk = 0.0037313
k( 12) = ( 0.0000000 0.0000000 0.2443059), wk = 0.0037313
k( 13) = ( 0.0000000 0.0000000 0.2665155), wk = 0.0037313
k( 14) = ( 0.0000000 0.0000000 0.2887251), wk = 0.0037313
k( 15) = ( 0.0000000 0.0000000 0.3109347), wk = 0.0037313
k( 16) = ( 0.0000000 0.0000000 0.3331443), wk = 0.0037313
k( 17) = ( 0.0000000 0.0000000 0.3553540), wk = 0.0037313
k( 18) = ( 0.0000000 0.0000000 0.3775636), wk = 0.0037313
k( 19) = ( 0.0000000 0.0000000 0.3997732), wk = 0.0037313
k( 20) = ( 0.0000000 0.0000000 0.4219828), wk = 0.0037313
k( 21) = ( 0.0000000 0.0000000 0.4441925), wk = 0.0037313
k( 22) = ( 0.0000000 0.0000000 0.4664021), wk = 0.0037313
k( 23) = ( 0.0000000 0.0000000 0.4886117), wk = 0.0037313
k( 24) = ( 0.0000000 0.0000000 0.5108213), wk = 0.0037313
k( 25) = ( 0.0000000 0.0000000 0.5330310), wk = 0.0037313
k( 26) = ( 0.0000000 0.0000000 0.5552406), wk = 0.0037313
k( 27) = ( 0.0000000 0.0000000 0.5774502), wk = 0.0037313
k( 28) = ( 0.0000000 0.0000000 0.5996598), wk = 0.0037313
k( 29) = ( 0.0000000 0.0000000 0.6218695), wk = 0.0037313
k( 30) = ( 0.0000000 0.0000000 0.6440791), wk = 0.0037313
k( 31) = ( 0.0000000 0.0000000 0.6662887), wk = 0.0037313
k( 32) = ( 0.0000000 0.0000000 0.6884983), wk = 0.0037313
k( 33) = ( 0.0000000 0.0000000 0.7107080), wk = 0.0037313
k( 34) = ( 0.0000000 0.0000000 0.7329176), wk = 0.0037313
k( 35) = ( 0.0000000 0.0000000 0.7551272), wk = 0.0037313
k( 36) = ( 0.0000000 0.0000000 0.7773368), wk = 0.0037313
k( 37) = ( 0.0000000 0.0000000 0.7995464), wk = 0.0037313
k( 38) = ( 0.0000000 0.0000000 0.8217561), wk = 0.0037313
k( 39) = ( 0.0000000 0.0000000 0.8439657), wk = 0.0037313
k( 40) = ( 0.0000000 0.0000000 0.8661753), wk = 0.0037313
k( 41) = ( 0.0000000 0.0000000 0.8661753), wk = 0.0037313
k( 42) = ( -0.0124935 0.0176731 0.8661753), wk = 0.0037313
k( 43) = ( -0.0249870 0.0353462 0.8661753), wk = 0.0037313
k( 44) = ( -0.0374805 0.0530192 0.8661753), wk = 0.0037313
k( 45) = ( -0.0499740 0.0706923 0.8661753), wk = 0.0037313
k( 46) = ( -0.0624676 0.0883654 0.8661753), wk = 0.0037313
k( 47) = ( -0.0749611 0.1060385 0.8661753), wk = 0.0037313
k( 48) = ( -0.0874546 0.1237116 0.8661753), wk = 0.0037313
k( 49) = ( -0.0999481 0.1413846 0.8661753), wk = 0.0037313
k( 50) = ( -0.1124416 0.1590577 0.8661753), wk = 0.0037313
k( 51) = ( -0.1249351 0.1767308 0.8661753), wk = 0.0037313
k( 52) = ( -0.1249351 0.1767308 0.8661753), wk = 0.0037313
k( 53) = ( -0.1338652 0.1893632 0.8507052), wk = 0.0037313
k( 54) = ( -0.1427953 0.2019956 0.8352351), wk = 0.0037313
k( 55) = ( -0.1517255 0.2146279 0.8197650), wk = 0.0037313
k( 56) = ( -0.1606556 0.2272603 0.8042949), wk = 0.0037313
k( 57) = ( -0.1695857 0.2398927 0.7888249), wk = 0.0037313
k( 58) = ( -0.1785158 0.2525250 0.7733548), wk = 0.0037313
k( 59) = ( -0.1874459 0.2651574 0.7578847), wk = 0.0037313
k( 60) = ( -0.1963760 0.2777898 0.7424146), wk = 0.0037313
k( 61) = ( -0.2053062 0.2904221 0.7269445), wk = 0.0037313
k( 62) = ( -0.2142363 0.3030545 0.7114744), wk = 0.0037313
k( 63) = ( -0.2231664 0.3156869 0.6960043), wk = 0.0037313
k( 64) = ( -0.2320965 0.3283193 0.6805342), wk = 0.0037313
k( 65) = ( -0.2410266 0.3409516 0.6650641), wk = 0.0037313
k( 66) = ( -0.2499567 0.3535840 0.6495940), wk = 0.0037313
k( 67) = ( -0.2588869 0.3662164 0.6341239), wk = 0.0037313
k( 68) = ( -0.2678170 0.3788487 0.6186538), wk = 0.0037313
k( 69) = ( -0.2767471 0.3914811 0.6031837), wk = 0.0037313
k( 70) = ( -0.2856772 0.4041135 0.5877137), wk = 0.0037313
k( 71) = ( -0.2946073 0.4167458 0.5722436), wk = 0.0037313
k( 72) = ( -0.3035374 0.4293782 0.5567735), wk = 0.0037313
k( 73) = ( -0.3124676 0.4420106 0.5413034), wk = 0.0037313
k( 74) = ( -0.3124676 0.4420106 0.5413034), wk = 0.0037313
k( 75) = ( -0.3032773 0.4290103 0.5253827), wk = 0.0037313
k( 76) = ( -0.2940871 0.4160100 0.5094620), wk = 0.0037313
k( 77) = ( -0.2848969 0.4030097 0.4935413), wk = 0.0037313
k( 78) = ( -0.2757067 0.3900094 0.4776206), wk = 0.0037313
k( 79) = ( -0.2665165 0.3770090 0.4616999), wk = 0.0037313
k( 80) = ( -0.2573262 0.3640087 0.4457792), wk = 0.0037313
k( 81) = ( -0.2481360 0.3510084 0.4298586), wk = 0.0037313
k( 82) = ( -0.2389458 0.3380081 0.4139379), wk = 0.0037313
k( 83) = ( -0.2297556 0.3250078 0.3980172), wk = 0.0037313
k( 84) = ( -0.2205653 0.3120075 0.3820965), wk = 0.0037313
k( 85) = ( -0.2113751 0.2990072 0.3661758), wk = 0.0037313
k( 86) = ( -0.2021849 0.2860069 0.3502551), wk = 0.0037313
k( 87) = ( -0.1929947 0.2730065 0.3343344), wk = 0.0037313
k( 88) = ( -0.1838044 0.2600062 0.3184137), wk = 0.0037313
k( 89) = ( -0.1746142 0.2470059 0.3024931), wk = 0.0037313
k( 90) = ( -0.1654240 0.2340056 0.2865724), wk = 0.0037313
k( 91) = ( -0.1562338 0.2210053 0.2706517), wk = 0.0037313
k( 92) = ( -0.1470436 0.2080050 0.2547310), wk = 0.0037313
k( 93) = ( -0.1378533 0.1950047 0.2388103), wk = 0.0037313
k( 94) = ( -0.1286631 0.1820044 0.2228896), wk = 0.0037313
k( 95) = ( -0.1194729 0.1690041 0.2069689), wk = 0.0037313
k( 96) = ( -0.1102827 0.1560037 0.1910483), wk = 0.0037313
k( 97) = ( -0.1010924 0.1430034 0.1751276), wk = 0.0037313
k( 98) = ( -0.0919022 0.1300031 0.1592069), wk = 0.0037313
k( 99) = ( -0.0827120 0.1170028 0.1432862), wk = 0.0037313
k( 100) = ( -0.0735218 0.1040025 0.1273655), wk = 0.0037313
k( 101) = ( -0.0643316 0.0910022 0.1114448), wk = 0.0037313
k( 102) = ( -0.0551413 0.0780019 0.0955241), wk = 0.0037313
k( 103) = ( -0.0459511 0.0650016 0.0796034), wk = 0.0037313
k( 104) = ( -0.0367609 0.0520012 0.0636828), wk = 0.0037313
k( 105) = ( -0.0275707 0.0390009 0.0477621), wk = 0.0037313
k( 106) = ( -0.0183804 0.0260006 0.0318414), wk = 0.0037313
k( 107) = ( -0.0091902 0.0130003 0.0159207), wk = 0.0037313
k( 108) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037313
k( 109) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037313
k( 110) = ( 0.0178571 0.0126236 0.0000000), wk = 0.0037313
k( 111) = ( 0.0357143 0.0252473 0.0000000), wk = 0.0037313
k( 112) = ( 0.0535714 0.0378709 0.0000000), wk = 0.0037313
k( 113) = ( 0.0714286 0.0504945 0.0000000), wk = 0.0037313
k( 114) = ( 0.0892857 0.0631181 0.0000000), wk = 0.0037313
k( 115) = ( 0.1071429 0.0757418 0.0000000), wk = 0.0037313
k( 116) = ( 0.1250000 0.0883654 0.0000000), wk = 0.0037313
k( 117) = ( 0.1428571 0.1009890 0.0000000), wk = 0.0037313
k( 118) = ( 0.1607143 0.1136127 0.0000000), wk = 0.0037313
k( 119) = ( 0.1785714 0.1262363 0.0000000), wk = 0.0037313
k( 120) = ( 0.1964286 0.1388599 0.0000000), wk = 0.0037313
k( 121) = ( 0.2142857 0.1514835 0.0000000), wk = 0.0037313
k( 122) = ( 0.2321429 0.1641072 0.0000000), wk = 0.0037313
k( 123) = ( 0.2500000 0.1767308 0.0000000), wk = 0.0037313
k( 124) = ( 0.2678571 0.1893544 0.0000000), wk = 0.0037313
k( 125) = ( 0.2857143 0.2019781 0.0000000), wk = 0.0037313
k( 126) = ( 0.3035714 0.2146017 0.0000000), wk = 0.0037313
k( 127) = ( 0.3214286 0.2272253 0.0000000), wk = 0.0037313
k( 128) = ( 0.3392857 0.2398489 0.0000000), wk = 0.0037313
k( 129) = ( 0.3571429 0.2524726 0.0000000), wk = 0.0037313
k( 130) = ( 0.3750000 0.2650962 0.0000000), wk = 0.0037313
k( 131) = ( 0.3928571 0.2777198 0.0000000), wk = 0.0037313
k( 132) = ( 0.4107143 0.2903435 0.0000000), wk = 0.0037313
k( 133) = ( 0.4285714 0.3029671 0.0000000), wk = 0.0037313
k( 134) = ( 0.4464286 0.3155907 0.0000000), wk = 0.0037313
k( 135) = ( 0.4642857 0.3282144 0.0000000), wk = 0.0037313
k( 136) = ( 0.4821429 0.3408380 0.0000000), wk = 0.0037313
k( 137) = ( 0.5000000 0.3534616 0.0000000), wk = 0.0037313
k( 138) = ( 0.5000000 0.3534616 0.0000000), wk = 0.0037313
k( 139) = ( 0.4910699 0.3660940 0.0154701), wk = 0.0037313
k( 140) = ( 0.4821398 0.3787264 0.0309402), wk = 0.0037313
k( 141) = ( 0.4732096 0.3913587 0.0464103), wk = 0.0037313
k( 142) = ( 0.4642795 0.4039911 0.0618804), wk = 0.0037313
k( 143) = ( 0.4553494 0.4166235 0.0773505), wk = 0.0037313
k( 144) = ( 0.4464193 0.4292558 0.0928206), wk = 0.0037313
k( 145) = ( 0.4374892 0.4418882 0.1082906), wk = 0.0037313
k( 146) = ( 0.4285591 0.4545206 0.1237607), wk = 0.0037313
k( 147) = ( 0.4196290 0.4671530 0.1392308), wk = 0.0037313
k( 148) = ( 0.4106988 0.4797853 0.1547009), wk = 0.0037313
k( 149) = ( 0.4017687 0.4924177 0.1701710), wk = 0.0037313
k( 150) = ( 0.3928386 0.5050501 0.1856411), wk = 0.0037313
k( 151) = ( 0.3839085 0.5176824 0.2011112), wk = 0.0037313
k( 152) = ( 0.3749784 0.5303148 0.2165813), wk = 0.0037313
k( 153) = ( 0.3660483 0.5429472 0.2320514), wk = 0.0037313
k( 154) = ( 0.3571181 0.5555795 0.2475215), wk = 0.0037313
k( 155) = ( 0.3481880 0.5682119 0.2629916), wk = 0.0037313
k( 156) = ( 0.3392579 0.5808443 0.2784617), wk = 0.0037313
k( 157) = ( 0.3303278 0.5934767 0.2939318), wk = 0.0037313
k( 158) = ( 0.3213977 0.6061090 0.3094019), wk = 0.0037313
k( 159) = ( 0.3124676 0.6187414 0.3248719), wk = 0.0037313
k( 160) = ( 0.3124676 0.6187414 0.3248719), wk = 0.0037313
k( 161) = ( 0.2929383 0.6132186 0.3316354), wk = 0.0037313
k( 162) = ( 0.2734091 0.6076957 0.3383989), wk = 0.0037313
k( 163) = ( 0.2538799 0.6021729 0.3451624), wk = 0.0037313
k( 164) = ( 0.2343507 0.5966500 0.3519259), wk = 0.0037313
k( 165) = ( 0.2148214 0.5911272 0.3586894), wk = 0.0037313
k( 166) = ( 0.1952922 0.5856044 0.3654528), wk = 0.0037313
k( 167) = ( 0.1757630 0.5800815 0.3722163), wk = 0.0037313
k( 168) = ( 0.1562338 0.5745587 0.3789798), wk = 0.0037313
k( 169) = ( 0.1367046 0.5690359 0.3857433), wk = 0.0037313
k( 170) = ( 0.1171753 0.5635130 0.3925068), wk = 0.0037313
k( 171) = ( 0.0976461 0.5579902 0.3992703), wk = 0.0037313
k( 172) = ( 0.0781169 0.5524673 0.4060337), wk = 0.0037313
k( 173) = ( 0.0585877 0.5469445 0.4127972), wk = 0.0037313
k( 174) = ( 0.0390584 0.5414217 0.4195607), wk = 0.0037313
k( 175) = ( 0.0195292 0.5358988 0.4263242), wk = 0.0037313
k( 176) = ( 0.0000000 0.5303760 0.4330877), wk = 0.0037313
k( 177) = ( 0.0000000 0.5303760 0.4330877), wk = 0.0037313
k( 178) = ( 0.0089286 0.5177458 0.4485551), wk = 0.0037313
k( 179) = ( 0.0178571 0.5051156 0.4640225), wk = 0.0037313
k( 180) = ( 0.0267857 0.4924854 0.4794899), wk = 0.0037313
k( 181) = ( 0.0357143 0.4798553 0.4949573), wk = 0.0037313
k( 182) = ( 0.0446429 0.4672251 0.5104247), wk = 0.0037313
k( 183) = ( 0.0535714 0.4545949 0.5258922), wk = 0.0037313
k( 184) = ( 0.0625000 0.4419647 0.5413596), wk = 0.0037313
k( 185) = ( 0.0714286 0.4293345 0.5568270), wk = 0.0037313
k( 186) = ( 0.0803571 0.4167043 0.5722944), wk = 0.0037313
k( 187) = ( 0.0892857 0.4040742 0.5877618), wk = 0.0037313
k( 188) = ( 0.0982143 0.3914440 0.6032292), wk = 0.0037313
k( 189) = ( 0.1071429 0.3788138 0.6186967), wk = 0.0037313
k( 190) = ( 0.1160714 0.3661836 0.6341641), wk = 0.0037313
k( 191) = ( 0.1250000 0.3535534 0.6496315), wk = 0.0037313
k( 192) = ( 0.1339286 0.3409232 0.6650989), wk = 0.0037313
k( 193) = ( 0.1428571 0.3282930 0.6805663), wk = 0.0037313
k( 194) = ( 0.1517857 0.3156629 0.6960337), wk = 0.0037313
k( 195) = ( 0.1607143 0.3030327 0.7115012), wk = 0.0037313
k( 196) = ( 0.1696429 0.2904025 0.7269686), wk = 0.0037313
k( 197) = ( 0.1785714 0.2777723 0.7424360), wk = 0.0037313
k( 198) = ( 0.1875000 0.2651421 0.7579034), wk = 0.0037313
k( 199) = ( 0.1964286 0.2525119 0.7733708), wk = 0.0037313
k( 200) = ( 0.2053571 0.2398817 0.7888382), wk = 0.0037313
k( 201) = ( 0.2142857 0.2272516 0.8043056), wk = 0.0037313
k( 202) = ( 0.2232143 0.2146214 0.8197731), wk = 0.0037313
k( 203) = ( 0.2321429 0.2019912 0.8352405), wk = 0.0037313
k( 204) = ( 0.2410714 0.1893610 0.8507079), wk = 0.0037313
k( 205) = ( 0.2500000 0.1767308 0.8661753), wk = 0.0037313
k( 206) = ( 0.2500000 0.1767308 0.8661753), wk = 0.0037313
k( 207) = ( 0.2647059 0.1871267 0.8534440), wk = 0.0037313
k( 208) = ( 0.2794118 0.1975227 0.8407128), wk = 0.0037313
k( 209) = ( 0.2941177 0.2079186 0.8279815), wk = 0.0037313
k( 210) = ( 0.3088235 0.2183145 0.8152503), wk = 0.0037313
k( 211) = ( 0.3235294 0.2287105 0.8025190), wk = 0.0037313
k( 212) = ( 0.3382353 0.2391064 0.7897878), wk = 0.0037313
k( 213) = ( 0.3529412 0.2495023 0.7770565), wk = 0.0037313
k( 214) = ( 0.3676471 0.2598982 0.7643252), wk = 0.0037313
k( 215) = ( 0.3823529 0.2702942 0.7515940), wk = 0.0037313
k( 216) = ( 0.3970588 0.2806901 0.7388627), wk = 0.0037313
k( 217) = ( 0.4117647 0.2910860 0.7261315), wk = 0.0037313
k( 218) = ( 0.4264706 0.3014820 0.7134002), wk = 0.0037313
k( 219) = ( 0.4411765 0.3118779 0.7006689), wk = 0.0037313
k( 220) = ( 0.4558823 0.3222738 0.6879377), wk = 0.0037313
k( 221) = ( 0.4705882 0.3326698 0.6752064), wk = 0.0037313
k( 222) = ( 0.4852941 0.3430657 0.6624752), wk = 0.0037313
k( 223) = ( 0.5000000 0.3534616 0.6497439), wk = 0.0037313
k( 224) = ( 0.5000000 0.3534616 0.6497439), wk = 0.0037313
k( 225) = ( 0.5000000 0.3534616 0.6273389), wk = 0.0037313
k( 226) = ( 0.5000000 0.3534616 0.6049340), wk = 0.0037313
k( 227) = ( 0.5000000 0.3534616 0.5825290), wk = 0.0037313
k( 228) = ( 0.5000000 0.3534616 0.5601241), wk = 0.0037313
k( 229) = ( 0.5000000 0.3534616 0.5377191), wk = 0.0037313
k( 230) = ( 0.5000000 0.3534616 0.5153141), wk = 0.0037313
k( 231) = ( 0.5000000 0.3534616 0.4929092), wk = 0.0037313
k( 232) = ( 0.5000000 0.3534616 0.4705042), wk = 0.0037313
k( 233) = ( 0.5000000 0.3534616 0.4480992), wk = 0.0037313
k( 234) = ( 0.5000000 0.3534616 0.4256943), wk = 0.0037313
k( 235) = ( 0.5000000 0.3534616 0.4032893), wk = 0.0037313
k( 236) = ( 0.5000000 0.3534616 0.3808843), wk = 0.0037313
k( 237) = ( 0.5000000 0.3534616 0.3584794), wk = 0.0037313
k( 238) = ( 0.5000000 0.3534616 0.3360744), wk = 0.0037313
k( 239) = ( 0.5000000 0.3534616 0.3136695), wk = 0.0037313
k( 240) = ( 0.5000000 0.3534616 0.2912645), wk = 0.0037313
k( 241) = ( 0.5000000 0.3534616 0.2688595), wk = 0.0037313
k( 242) = ( 0.5000000 0.3534616 0.2464546), wk = 0.0037313
k( 243) = ( 0.5000000 0.3534616 0.2240496), wk = 0.0037313
k( 244) = ( 0.5000000 0.3534616 0.2016447), wk = 0.0037313
k( 245) = ( 0.5000000 0.3534616 0.1792397), wk = 0.0037313
k( 246) = ( 0.5000000 0.3534616 0.1568347), wk = 0.0037313
k( 247) = ( 0.5000000 0.3534616 0.1344298), wk = 0.0037313
k( 248) = ( 0.5000000 0.3534616 0.1120248), wk = 0.0037313
k( 249) = ( 0.5000000 0.3534616 0.0896199), wk = 0.0037313
k( 250) = ( 0.5000000 0.3534616 0.0672149), wk = 0.0037313
k( 251) = ( 0.5000000 0.3534616 0.0448099), wk = 0.0037313
k( 252) = ( 0.5000000 0.3534616 0.0224050), wk = 0.0037313
k( 253) = ( 0.5000000 0.3534616 0.0000000), wk = 0.0037313
k( 254) = ( 0.0000000 0.0000000 0.8661753), wk = 0.0037313
k( 255) = ( 0.0178571 0.0126236 0.8661753), wk = 0.0037313
k( 256) = ( 0.0357143 0.0252473 0.8661753), wk = 0.0037313
k( 257) = ( 0.0535714 0.0378709 0.8661753), wk = 0.0037313
k( 258) = ( 0.0714286 0.0504945 0.8661753), wk = 0.0037313
k( 259) = ( 0.0892857 0.0631181 0.8661753), wk = 0.0037313
k( 260) = ( 0.1071429 0.0757418 0.8661753), wk = 0.0037313
k( 261) = ( 0.1250000 0.0883654 0.8661753), wk = 0.0037313
k( 262) = ( 0.1428571 0.1009890 0.8661753), wk = 0.0037313
k( 263) = ( 0.1607143 0.1136127 0.8661753), wk = 0.0037313
k( 264) = ( 0.1785714 0.1262363 0.8661753), wk = 0.0037313
k( 265) = ( 0.1964286 0.1388599 0.8661753), wk = 0.0037313
k( 266) = ( 0.2142857 0.1514835 0.8661753), wk = 0.0037313
k( 267) = ( 0.2321429 0.1641072 0.8661753), wk = 0.0037313
k( 268) = ( 0.2500000 0.1767308 0.8661753), wk = 0.0037313
cryst. coord.
k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037313
k( 2) = ( 0.0000000 0.0000000 0.0128205), wk = 0.0037313
k( 3) = ( 0.0000000 0.0000000 0.0256410), wk = 0.0037313
k( 4) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0037313
k( 5) = ( 0.0000000 0.0000000 0.0512821), wk = 0.0037313
k( 6) = ( 0.0000000 0.0000000 0.0641026), wk = 0.0037313
k( 7) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0037313
k( 8) = ( 0.0000000 0.0000000 0.0897436), wk = 0.0037313
k( 9) = ( 0.0000000 0.0000000 0.1025641), wk = 0.0037313
k( 10) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0037313
k( 11) = ( 0.0000000 0.0000000 0.1282051), wk = 0.0037313
k( 12) = ( 0.0000000 0.0000000 0.1410256), wk = 0.0037313
k( 13) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0037313
k( 14) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0037313
k( 15) = ( 0.0000000 0.0000000 0.1794872), wk = 0.0037313
k( 16) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0037313
k( 17) = ( 0.0000000 0.0000000 0.2051282), wk = 0.0037313
k( 18) = ( 0.0000000 0.0000000 0.2179487), wk = 0.0037313
k( 19) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0037313
k( 20) = ( 0.0000000 0.0000000 0.2435897), wk = 0.0037313
k( 21) = ( 0.0000000 0.0000000 0.2564103), wk = 0.0037313
k( 22) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0037313
k( 23) = ( 0.0000000 0.0000000 0.2820513), wk = 0.0037313
k( 24) = ( 0.0000000 0.0000000 0.2948718), wk = 0.0037313
k( 25) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0037313
k( 26) = ( 0.0000000 0.0000000 0.3205128), wk = 0.0037313
k( 27) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0037313
k( 28) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0037313
k( 29) = ( 0.0000000 0.0000000 0.3589744), wk = 0.0037313
k( 30) = ( 0.0000000 0.0000000 0.3717949), wk = 0.0037313
k( 31) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0037313
k( 32) = ( 0.0000000 0.0000000 0.3974359), wk = 0.0037313
k( 33) = ( 0.0000000 0.0000000 0.4102564), wk = 0.0037313
k( 34) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0037313
k( 35) = ( 0.0000000 0.0000000 0.4358974), wk = 0.0037313
k( 36) = ( 0.0000000 0.0000000 0.4487180), wk = 0.0037313
k( 37) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0037313
k( 38) = ( 0.0000000 0.0000000 0.4743590), wk = 0.0037313
k( 39) = ( 0.0000000 0.0000000 0.4871795), wk = 0.0037313
k( 40) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037313
k( 41) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037313
k( 42) = ( -0.0124935 0.0124935 0.5000000), wk = 0.0037313
k( 43) = ( -0.0249870 0.0249870 0.5000000), wk = 0.0037313
k( 44) = ( -0.0374805 0.0374805 0.5000000), wk = 0.0037313
k( 45) = ( -0.0499740 0.0499740 0.5000000), wk = 0.0037313
k( 46) = ( -0.0624676 0.0624676 0.5000000), wk = 0.0037313
k( 47) = ( -0.0749611 0.0749611 0.5000000), wk = 0.0037313
k( 48) = ( -0.0874546 0.0874546 0.5000000), wk = 0.0037313
k( 49) = ( -0.0999481 0.0999481 0.5000000), wk = 0.0037313
k( 50) = ( -0.1124416 0.1124416 0.5000000), wk = 0.0037313
k( 51) = ( -0.1249351 0.1249351 0.5000000), wk = 0.0037313
k( 52) = ( -0.1249351 0.1249351 0.5000000), wk = 0.0037313
k( 53) = ( -0.1338652 0.1338652 0.4910699), wk = 0.0037313
k( 54) = ( -0.1427953 0.1427953 0.4821398), wk = 0.0037313
k( 55) = ( -0.1517255 0.1517255 0.4732097), wk = 0.0037313
k( 56) = ( -0.1606556 0.1606556 0.4642795), wk = 0.0037313
k( 57) = ( -0.1695857 0.1695857 0.4553494), wk = 0.0037313
k( 58) = ( -0.1785158 0.1785158 0.4464193), wk = 0.0037313
k( 59) = ( -0.1874459 0.1874459 0.4374892), wk = 0.0037313
k( 60) = ( -0.1963760 0.1963760 0.4285591), wk = 0.0037313
k( 61) = ( -0.2053062 0.2053062 0.4196290), wk = 0.0037313
k( 62) = ( -0.2142363 0.2142363 0.4106988), wk = 0.0037313
k( 63) = ( -0.2231664 0.2231664 0.4017687), wk = 0.0037313
k( 64) = ( -0.2320965 0.2320965 0.3928386), wk = 0.0037313
k( 65) = ( -0.2410266 0.2410266 0.3839085), wk = 0.0037313
k( 66) = ( -0.2499567 0.2499567 0.3749784), wk = 0.0037313
k( 67) = ( -0.2588869 0.2588869 0.3660482), wk = 0.0037313
k( 68) = ( -0.2678170 0.2678170 0.3571181), wk = 0.0037313
k( 69) = ( -0.2767471 0.2767471 0.3481880), wk = 0.0037313
k( 70) = ( -0.2856772 0.2856772 0.3392579), wk = 0.0037313
k( 71) = ( -0.2946073 0.2946073 0.3303278), wk = 0.0037313
k( 72) = ( -0.3035374 0.3035374 0.3213977), wk = 0.0037313
k( 73) = ( -0.3124676 0.3124676 0.3124676), wk = 0.0037313
k( 74) = ( -0.3124676 0.3124676 0.3124676), wk = 0.0037313
k( 75) = ( -0.3032773 0.3032773 0.3032773), wk = 0.0037313
k( 76) = ( -0.2940871 0.2940871 0.2940871), wk = 0.0037313
k( 77) = ( -0.2848969 0.2848969 0.2848969), wk = 0.0037313
k( 78) = ( -0.2757067 0.2757067 0.2757067), wk = 0.0037313
k( 79) = ( -0.2665165 0.2665165 0.2665165), wk = 0.0037313
k( 80) = ( -0.2573262 0.2573262 0.2573262), wk = 0.0037313
k( 81) = ( -0.2481360 0.2481360 0.2481360), wk = 0.0037313
k( 82) = ( -0.2389458 0.2389458 0.2389458), wk = 0.0037313
k( 83) = ( -0.2297556 0.2297556 0.2297556), wk = 0.0037313
k( 84) = ( -0.2205653 0.2205653 0.2205653), wk = 0.0037313
k( 85) = ( -0.2113751 0.2113751 0.2113751), wk = 0.0037313
k( 86) = ( -0.2021849 0.2021849 0.2021849), wk = 0.0037313
k( 87) = ( -0.1929947 0.1929947 0.1929947), wk = 0.0037313
k( 88) = ( -0.1838044 0.1838044 0.1838044), wk = 0.0037313
k( 89) = ( -0.1746142 0.1746142 0.1746142), wk = 0.0037313
k( 90) = ( -0.1654240 0.1654240 0.1654240), wk = 0.0037313
k( 91) = ( -0.1562338 0.1562338 0.1562338), wk = 0.0037313
k( 92) = ( -0.1470436 0.1470436 0.1470436), wk = 0.0037313
k( 93) = ( -0.1378533 0.1378533 0.1378533), wk = 0.0037313
k( 94) = ( -0.1286631 0.1286631 0.1286631), wk = 0.0037313
k( 95) = ( -0.1194729 0.1194729 0.1194729), wk = 0.0037313
k( 96) = ( -0.1102827 0.1102827 0.1102827), wk = 0.0037313
k( 97) = ( -0.1010924 0.1010924 0.1010924), wk = 0.0037313
k( 98) = ( -0.0919022 0.0919022 0.0919022), wk = 0.0037313
k( 99) = ( -0.0827120 0.0827120 0.0827120), wk = 0.0037313
k( 100) = ( -0.0735218 0.0735218 0.0735218), wk = 0.0037313
k( 101) = ( -0.0643316 0.0643316 0.0643316), wk = 0.0037313
k( 102) = ( -0.0551413 0.0551413 0.0551413), wk = 0.0037313
k( 103) = ( -0.0459511 0.0459511 0.0459511), wk = 0.0037313
k( 104) = ( -0.0367609 0.0367609 0.0367609), wk = 0.0037313
k( 105) = ( -0.0275707 0.0275707 0.0275707), wk = 0.0037313
k( 106) = ( -0.0183804 0.0183804 0.0183804), wk = 0.0037313
k( 107) = ( -0.0091902 0.0091902 0.0091902), wk = 0.0037313
k( 108) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037313
k( 109) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037313
k( 110) = ( 0.0178571 0.0178571 -0.0178571), wk = 0.0037313
k( 111) = ( 0.0357143 0.0357143 -0.0357143), wk = 0.0037313
k( 112) = ( 0.0535714 0.0535714 -0.0535714), wk = 0.0037313
k( 113) = ( 0.0714286 0.0714286 -0.0714286), wk = 0.0037313
k( 114) = ( 0.0892857 0.0892857 -0.0892857), wk = 0.0037313
k( 115) = ( 0.1071429 0.1071429 -0.1071429), wk = 0.0037313
k( 116) = ( 0.1250000 0.1250000 -0.1250000), wk = 0.0037313
k( 117) = ( 0.1428571 0.1428571 -0.1428571), wk = 0.0037313
k( 118) = ( 0.1607143 0.1607143 -0.1607143), wk = 0.0037313
k( 119) = ( 0.1785714 0.1785714 -0.1785714), wk = 0.0037313
k( 120) = ( 0.1964286 0.1964286 -0.1964286), wk = 0.0037313
k( 121) = ( 0.2142857 0.2142857 -0.2142857), wk = 0.0037313
k( 122) = ( 0.2321429 0.2321429 -0.2321429), wk = 0.0037313
k( 123) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0037313
k( 124) = ( 0.2678571 0.2678571 -0.2678571), wk = 0.0037313
k( 125) = ( 0.2857143 0.2857143 -0.2857143), wk = 0.0037313
k( 126) = ( 0.3035714 0.3035714 -0.3035714), wk = 0.0037313
k( 127) = ( 0.3214286 0.3214286 -0.3214286), wk = 0.0037313
k( 128) = ( 0.3392857 0.3392857 -0.3392857), wk = 0.0037313
k( 129) = ( 0.3571429 0.3571429 -0.3571429), wk = 0.0037313
k( 130) = ( 0.3750000 0.3750000 -0.3750000), wk = 0.0037313
k( 131) = ( 0.3928571 0.3928571 -0.3928571), wk = 0.0037313
k( 132) = ( 0.4107143 0.4107143 -0.4107143), wk = 0.0037313
k( 133) = ( 0.4285714 0.4285714 -0.4285714), wk = 0.0037313
k( 134) = ( 0.4464286 0.4464286 -0.4464286), wk = 0.0037313
k( 135) = ( 0.4642857 0.4642857 -0.4642857), wk = 0.0037313
k( 136) = ( 0.4821429 0.4821429 -0.4821429), wk = 0.0037313
k( 137) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0037313
k( 138) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0037313
k( 139) = ( 0.4910699 0.5089301 -0.4910699), wk = 0.0037313
k( 140) = ( 0.4821398 0.5178602 -0.4821398), wk = 0.0037313
k( 141) = ( 0.4732096 0.5267903 -0.4732096), wk = 0.0037313
k( 142) = ( 0.4642795 0.5357205 -0.4642795), wk = 0.0037313
k( 143) = ( 0.4553494 0.5446506 -0.4553494), wk = 0.0037313
k( 144) = ( 0.4464193 0.5535807 -0.4464193), wk = 0.0037313
k( 145) = ( 0.4374892 0.5625108 -0.4374892), wk = 0.0037313
k( 146) = ( 0.4285591 0.5714409 -0.4285591), wk = 0.0037313
k( 147) = ( 0.4196290 0.5803710 -0.4196289), wk = 0.0037313
k( 148) = ( 0.4106988 0.5893012 -0.4106988), wk = 0.0037313
k( 149) = ( 0.4017687 0.5982313 -0.4017687), wk = 0.0037313
k( 150) = ( 0.3928386 0.6071614 -0.3928386), wk = 0.0037313
k( 151) = ( 0.3839085 0.6160915 -0.3839085), wk = 0.0037313
k( 152) = ( 0.3749784 0.6250216 -0.3749784), wk = 0.0037313
k( 153) = ( 0.3660483 0.6339518 -0.3660482), wk = 0.0037313
k( 154) = ( 0.3571181 0.6428819 -0.3571181), wk = 0.0037313
k( 155) = ( 0.3481880 0.6518120 -0.3481880), wk = 0.0037313
k( 156) = ( 0.3392579 0.6607421 -0.3392579), wk = 0.0037313
k( 157) = ( 0.3303278 0.6696722 -0.3303278), wk = 0.0037313
k( 158) = ( 0.3213977 0.6786023 -0.3213977), wk = 0.0037313
k( 159) = ( 0.3124676 0.6875324 -0.3124676), wk = 0.0037313
k( 160) = ( 0.3124676 0.6875324 -0.3124676), wk = 0.0037313
k( 161) = ( 0.2929383 0.6758117 -0.2929383), wk = 0.0037313
k( 162) = ( 0.2734091 0.6640909 -0.2734091), wk = 0.0037313
k( 163) = ( 0.2538799 0.6523701 -0.2538799), wk = 0.0037313
k( 164) = ( 0.2343507 0.6406493 -0.2343507), wk = 0.0037313
k( 165) = ( 0.2148214 0.6289286 -0.2148214), wk = 0.0037313
k( 166) = ( 0.1952922 0.6172078 -0.1952922), wk = 0.0037313
k( 167) = ( 0.1757630 0.6054870 -0.1757630), wk = 0.0037313
k( 168) = ( 0.1562338 0.5937662 -0.1562338), wk = 0.0037313
k( 169) = ( 0.1367046 0.5820454 -0.1367046), wk = 0.0037313
k( 170) = ( 0.1171753 0.5703247 -0.1171753), wk = 0.0037313
k( 171) = ( 0.0976461 0.5586039 -0.0976461), wk = 0.0037313
k( 172) = ( 0.0781169 0.5468831 -0.0781169), wk = 0.0037313
k( 173) = ( 0.0585877 0.5351623 -0.0585877), wk = 0.0037313
k( 174) = ( 0.0390584 0.5234416 -0.0390584), wk = 0.0037313
k( 175) = ( 0.0195292 0.5117208 -0.0195292), wk = 0.0037313
k( 176) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0037313
k( 177) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0037313
k( 178) = ( 0.0089286 0.4910714 0.0089286), wk = 0.0037313
k( 179) = ( 0.0178571 0.4821429 0.0178571), wk = 0.0037313
k( 180) = ( 0.0267857 0.4732143 0.0267857), wk = 0.0037313
k( 181) = ( 0.0357143 0.4642857 0.0357143), wk = 0.0037313
k( 182) = ( 0.0446429 0.4553571 0.0446429), wk = 0.0037313
k( 183) = ( 0.0535714 0.4464286 0.0535714), wk = 0.0037313
k( 184) = ( 0.0625000 0.4375000 0.0625000), wk = 0.0037313
k( 185) = ( 0.0714286 0.4285714 0.0714286), wk = 0.0037313
k( 186) = ( 0.0803571 0.4196429 0.0803571), wk = 0.0037313
k( 187) = ( 0.0892857 0.4107143 0.0892857), wk = 0.0037313
k( 188) = ( 0.0982143 0.4017857 0.0982143), wk = 0.0037313
k( 189) = ( 0.1071429 0.3928571 0.1071429), wk = 0.0037313
k( 190) = ( 0.1160714 0.3839286 0.1160714), wk = 0.0037313
k( 191) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0037313
k( 192) = ( 0.1339286 0.3660714 0.1339286), wk = 0.0037313
k( 193) = ( 0.1428571 0.3571429 0.1428571), wk = 0.0037313
k( 194) = ( 0.1517857 0.3482143 0.1517857), wk = 0.0037313
k( 195) = ( 0.1607143 0.3392857 0.1607143), wk = 0.0037313
k( 196) = ( 0.1696429 0.3303571 0.1696429), wk = 0.0037313
k( 197) = ( 0.1785714 0.3214286 0.1785714), wk = 0.0037313
k( 198) = ( 0.1875000 0.3125000 0.1875000), wk = 0.0037313
k( 199) = ( 0.1964286 0.3035714 0.1964286), wk = 0.0037313
k( 200) = ( 0.2053571 0.2946429 0.2053571), wk = 0.0037313
k( 201) = ( 0.2142857 0.2857143 0.2142857), wk = 0.0037313
k( 202) = ( 0.2232143 0.2767857 0.2232143), wk = 0.0037313
k( 203) = ( 0.2321429 0.2678571 0.2321429), wk = 0.0037313
k( 204) = ( 0.2410714 0.2589286 0.2410714), wk = 0.0037313
k( 205) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0037313
k( 206) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0037313
k( 207) = ( 0.2647059 0.2647059 0.2279450), wk = 0.0037313
k( 208) = ( 0.2794118 0.2794118 0.2058900), wk = 0.0037313
k( 209) = ( 0.2941177 0.2941177 0.1838350), wk = 0.0037313
k( 210) = ( 0.3088235 0.3088235 0.1617800), wk = 0.0037313
k( 211) = ( 0.3235294 0.3235294 0.1397250), wk = 0.0037313
k( 212) = ( 0.3382353 0.3382353 0.1176700), wk = 0.0037313
k( 213) = ( 0.3529412 0.3529412 0.0956149), wk = 0.0037313
k( 214) = ( 0.3676471 0.3676471 0.0735600), wk = 0.0037313
k( 215) = ( 0.3823529 0.3823529 0.0515049), wk = 0.0037313
k( 216) = ( 0.3970588 0.3970588 0.0294499), wk = 0.0037313
k( 217) = ( 0.4117647 0.4117647 0.0073949), wk = 0.0037313
k( 218) = ( 0.4264706 0.4264706 -0.0146601), wk = 0.0037313
k( 219) = ( 0.4411765 0.4411765 -0.0367151), wk = 0.0037313
k( 220) = ( 0.4558823 0.4558823 -0.0587701), wk = 0.0037313
k( 221) = ( 0.4705882 0.4705882 -0.0808251), wk = 0.0037313
k( 222) = ( 0.4852941 0.4852941 -0.1028801), wk = 0.0037313
k( 223) = ( 0.5000000 0.5000000 -0.1249351), wk = 0.0037313
k( 224) = ( 0.5000000 0.5000000 -0.1249351), wk = 0.0037313
k( 225) = ( 0.5000000 0.5000000 -0.1378684), wk = 0.0037313
k( 226) = ( 0.5000000 0.5000000 -0.1508017), wk = 0.0037313
k( 227) = ( 0.5000000 0.5000000 -0.1637349), wk = 0.0037313
k( 228) = ( 0.5000000 0.5000000 -0.1766682), wk = 0.0037313
k( 229) = ( 0.5000000 0.5000000 -0.1896015), wk = 0.0037313
k( 230) = ( 0.5000000 0.5000000 -0.2025347), wk = 0.0037313
k( 231) = ( 0.5000000 0.5000000 -0.2154680), wk = 0.0037313
k( 232) = ( 0.5000000 0.5000000 -0.2284013), wk = 0.0037313
k( 233) = ( 0.5000000 0.5000000 -0.2413346), wk = 0.0037313
k( 234) = ( 0.5000000 0.5000000 -0.2542678), wk = 0.0037313
k( 235) = ( 0.5000000 0.5000000 -0.2672011), wk = 0.0037313
k( 236) = ( 0.5000000 0.5000000 -0.2801344), wk = 0.0037313
k( 237) = ( 0.5000000 0.5000000 -0.2930677), wk = 0.0037313
k( 238) = ( 0.5000000 0.5000000 -0.3060009), wk = 0.0037313
k( 239) = ( 0.5000000 0.5000000 -0.3189342), wk = 0.0037313
k( 240) = ( 0.5000000 0.5000000 -0.3318675), wk = 0.0037313
k( 241) = ( 0.5000000 0.5000000 -0.3448007), wk = 0.0037313
k( 242) = ( 0.5000000 0.5000000 -0.3577340), wk = 0.0037313
k( 243) = ( 0.5000000 0.5000000 -0.3706673), wk = 0.0037313
k( 244) = ( 0.5000000 0.5000000 -0.3836005), wk = 0.0037313
k( 245) = ( 0.5000000 0.5000000 -0.3965338), wk = 0.0037313
k( 246) = ( 0.5000000 0.5000000 -0.4094671), wk = 0.0037313
k( 247) = ( 0.5000000 0.5000000 -0.4224004), wk = 0.0037313
k( 248) = ( 0.5000000 0.5000000 -0.4353336), wk = 0.0037313
k( 249) = ( 0.5000000 0.5000000 -0.4482669), wk = 0.0037313
k( 250) = ( 0.5000000 0.5000000 -0.4612002), wk = 0.0037313
k( 251) = ( 0.5000000 0.5000000 -0.4741335), wk = 0.0037313
k( 252) = ( 0.5000000 0.5000000 -0.4870667), wk = 0.0037313
k( 253) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0037313
k( 254) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037313
k( 255) = ( 0.0178571 0.0178571 0.4821429), wk = 0.0037313
k( 256) = ( 0.0357143 0.0357143 0.4642857), wk = 0.0037313
k( 257) = ( 0.0535714 0.0535714 0.4464286), wk = 0.0037313
k( 258) = ( 0.0714286 0.0714286 0.4285714), wk = 0.0037313
k( 259) = ( 0.0892857 0.0892857 0.4107143), wk = 0.0037313
k( 260) = ( 0.1071429 0.1071429 0.3928571), wk = 0.0037313
k( 261) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0037313
k( 262) = ( 0.1428571 0.1428571 0.3571429), wk = 0.0037313
k( 263) = ( 0.1607143 0.1607143 0.3392857), wk = 0.0037313
k( 264) = ( 0.1785714 0.1785714 0.3214286), wk = 0.0037313
k( 265) = ( 0.1964286 0.1964286 0.3035714), wk = 0.0037313
k( 266) = ( 0.2142857 0.2142857 0.2857143), wk = 0.0037313
k( 267) = ( 0.2321429 0.2321429 0.2678571), wk = 0.0037313
k( 268) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0037313
Dense grid: 186527 G-vectors FFT dimensions: ( 90, 90, 90)
Smooth grid: 58469 G-vectors FFT dimensions: ( 60, 60, 60)
Largest allocated arrays est. size (Mb) dimensions
Kohn-Sham Wavefunctions 0.35 Mb ( 314, 74)
NL pseudopotentials 0.31 Mb ( 157, 130)
Each V/rho on FFT grid 0.25 Mb ( 16200)
Each G-vector array 0.03 Mb ( 3886)
G-vector shells 0.01 Mb ( 1809)
Largest temporary arrays est. size (Mb) dimensions
Auxiliary wavefunctions 1.42 Mb ( 314, 296)
Each subspace H/S matrix 1.34 Mb ( 296, 296)
Each <psi_i|beta_j> matrix 0.29 Mb ( 130, 2, 74)
The potential is recalculated from file :
./SnxHgSe2x2.save/charge-density.dat
Starting wfc are 86 randomized atomic wfcs
Band Structure Calculation
Davidson diagonalization with overlap
Computing kpt #: 1
total cpu time spent up to now is 48.3 secs
Computing kpt #: 2
total cpu time spent up to now is 54.8 secs
Computing kpt #: 3
total cpu time spent up to now is 61.3 secs
Computing kpt #: 4
total cpu time spent up to now is 67.8 secs
Computing kpt #: 5
total cpu time spent up to now is 74.4 secs
Computing kpt #: 6
total cpu time spent up to now is 81.1 secs
Computing kpt #: 7
total cpu time spent up to now is 87.7 secs
Computing kpt #: 8
total cpu time spent up to now is 94.3 secs
Computing kpt #: 9
total cpu time spent up to now is 100.9 secs
Computing kpt #: 10
total cpu time spent up to now is 107.6 secs
Computing kpt #: 11
total cpu time spent up to now is 114.4 secs
Computing kpt #: 12
total cpu time spent up to now is 121.8 secs
Computing kpt #: 13
total cpu time spent up to now is 128.7 secs
Computing kpt #: 14
total cpu time spent up to now is 135.7 secs
Computing kpt #: 15
total cpu time spent up to now is 142.7 secs
Computing kpt #: 16
total cpu time spent up to now is 149.7 secs
Computing kpt #: 17
total cpu time spent up to now is 156.8 secs
Computing kpt #: 18
total cpu time spent up to now is 163.9 secs
Computing kpt #: 19
total cpu time spent up to now is 171.0 secs
Computing kpt #: 20
total cpu time spent up to now is 178.1 secs
Computing kpt #: 21
total cpu time spent up to now is 185.2 secs
Computing kpt #: 22
total cpu time spent up to now is 192.4 secs
Computing kpt #: 23
total cpu time spent up to now is 199.7 secs
Computing kpt #: 24
total cpu time spent up to now is 207.0 secs
Computing kpt #: 25
total cpu time spent up to now is 214.2 secs
Computing kpt #: 26
total cpu time spent up to now is 221.4 secs
Computing kpt #: 27
total cpu time spent up to now is 228.6 secs
Computing kpt #: 28
total cpu time spent up to now is 236.0 secs
Computing kpt #: 29
total cpu time spent up to now is 245.2 secs
Computing kpt #: 30
total cpu time spent up to now is 252.3 secs
Computing kpt #: 31
total cpu time spent up to now is 259.9 secs
Computing kpt #: 32
total cpu time spent up to now is 267.1 secs
Computing kpt #: 33
total cpu time spent up to now is 274.3 secs
Computing kpt #: 34
total cpu time spent up to now is 282.3 secs
Computing kpt #: 35
total cpu time spent up to now is 290.4 secs
Computing kpt #: 36
total cpu time spent up to now is 298.4 secs
Computing kpt #: 37
total cpu time spent up to now is 306.3 secs
Computing kpt #: 38
total cpu time spent up to now is 313.7 secs
Computing kpt #: 39
total cpu time spent up to now is 321.0 secs
Computing kpt #: 40
total cpu time spent up to now is 328.2 secs
Computing kpt #: 41
total cpu time spent up to now is 335.5 secs
Computing kpt #: 42
total cpu time spent up to now is 342.9 secs
Computing kpt #: 43
total cpu time spent up to now is 350.7 secs
Computing kpt #: 44
total cpu time spent up to now is 358.6 secs
Computing kpt #: 45
total cpu time spent up to now is 366.6 secs
Computing kpt #: 46
total cpu time spent up to now is 374.6 secs
Computing kpt #: 47
total cpu time spent up to now is 382.7 secs
Computing kpt #: 48
total cpu time spent up to now is 390.8 secs
Computing kpt #: 49
total cpu time spent up to now is 398.5 secs
Computing kpt #: 50
total cpu time spent up to now is 406.2 secs
Computing kpt #: 51
total cpu time spent up to now is 413.8 secs
Computing kpt #: 52
total cpu time spent up to now is 421.8 secs
Computing kpt #: 53
total cpu time spent up to now is 429.6 secs
Computing kpt #: 54
total cpu time spent up to now is 437.4 secs
Computing kpt #: 55
total cpu time spent up to now is 445.3 secs
Computing kpt #: 56
total cpu time spent up to now is 453.3 secs
Computing kpt #: 57
total cpu time spent up to now is 461.4 secs
Computing kpt #: 58
total cpu time spent up to now is 469.4 secs
Computing kpt #: 59
total cpu time spent up to now is 477.4 secs
Computing kpt #: 60
total cpu time spent up to now is 485.4 secs
Computing kpt #: 61
total cpu time spent up to now is 493.2 secs
Computing kpt #: 62
total cpu time spent up to now is 500.4 secs
Computing kpt #: 63
total cpu time spent up to now is 507.8 secs
Computing kpt #: 64
total cpu time spent up to now is 515.2 secs
Computing kpt #: 65
total cpu time spent up to now is 522.6 secs
Computing kpt #: 66
total cpu time spent up to now is 530.0 secs
Computing kpt #: 67
total cpu time spent up to now is 538.3 secs
Computing kpt #: 68
total cpu time spent up to now is 547.6 secs
Computing kpt #: 69
total cpu time spent up to now is 555.2 secs
Computing kpt #: 70
total cpu time spent up to now is 563.2 secs
Computing kpt #: 71
total cpu time spent up to now is 570.9 secs
Computing kpt #: 72
total cpu time spent up to now is 578.9 secs
Computing kpt #: 73
total cpu time spent up to now is 586.3 secs
Computing kpt #: 74
total cpu time spent up to now is 594.0 secs
Computing kpt #: 75
total cpu time spent up to now is 601.5 secs
Computing kpt #: 76
total cpu time spent up to now is 608.8 secs
Computing kpt #: 77
total cpu time spent up to now is 616.1 secs
Computing kpt #: 78
total cpu time spent up to now is 623.6 secs
Computing kpt #: 79
total cpu time spent up to now is 631.0 secs
Computing kpt #: 80
total cpu time spent up to now is 638.3 secs
Computing kpt #: 81
total cpu time spent up to now is 645.6 secs
Computing kpt #: 82
total cpu time spent up to now is 652.9 secs
Computing kpt #: 83
total cpu time spent up to now is 660.0 secs
Computing kpt #: 84
total cpu time spent up to now is 667.0 secs
Computing kpt #: 85
total cpu time spent up to now is 673.7 secs
Computing kpt #: 86
total cpu time spent up to now is 680.5 secs
Computing kpt #: 87
total cpu time spent up to now is 687.3 secs
Computing kpt #: 88
total cpu time spent up to now is 693.9 secs
Computing kpt #: 89
total cpu time spent up to now is 700.7 secs
Computing kpt #: 90
total cpu time spent up to now is 707.3 secs
Computing kpt #: 91
total cpu time spent up to now is 713.9 secs
Computing kpt #: 92
total cpu time spent up to now is 720.9 secs
Computing kpt #: 93
total cpu time spent up to now is 727.6 secs
Computing kpt #: 94
total cpu time spent up to now is 734.3 secs
Computing kpt #: 95
total cpu time spent up to now is 741.0 secs
Computing kpt #: 96
total cpu time spent up to now is 747.7 secs
Computing kpt #: 97
total cpu time spent up to now is 754.4 secs
Computing kpt #: 98
total cpu time spent up to now is 761.1 secs
Computing kpt #: 99
total cpu time spent up to now is 767.8 secs
Computing kpt #: 100
total cpu time spent up to now is 774.5 secs
Computing kpt #: 101
total cpu time spent up to now is 781.1 secs
Computing kpt #: 102
total cpu time spent up to now is 788.0 secs
Computing kpt #: 103
total cpu time spent up to now is 794.6 secs
Computing kpt #: 104
total cpu time spent up to now is 801.4 secs
Computing kpt #: 105
total cpu time spent up to now is 808.0 secs
Computing kpt #: 106
total cpu time spent up to now is 814.5 secs
Computing kpt #: 107
total cpu time spent up to now is 821.0 secs
Computing kpt #: 108
total cpu time spent up to now is 827.3 secs
Computing kpt #: 109
total cpu time spent up to now is 833.7 secs
Computing kpt #: 110
total cpu time spent up to now is 841.2 secs
Computing kpt #: 111
total cpu time spent up to now is 847.8 secs
Computing kpt #: 112
total cpu time spent up to now is 854.3 secs
Computing kpt #: 113
total cpu time spent up to now is 861.0 secs
Computing kpt #: 114
total cpu time spent up to now is 867.6 secs
Computing kpt #: 115
total cpu time spent up to now is 874.4 secs
Computing kpt #: 116
total cpu time spent up to now is 881.0 secs
Computing kpt #: 117
total cpu time spent up to now is 887.6 secs
Computing kpt #: 118
total cpu time spent up to now is 894.0 secs
Computing kpt #: 119
total cpu time spent up to now is 900.5 secs
Computing kpt #: 120
total cpu time spent up to now is 906.8 secs
Computing kpt #: 121
total cpu time spent up to now is 913.3 secs
Computing kpt #: 122
total cpu time spent up to now is 919.7 secs
Computing kpt #: 123
total cpu time spent up to now is 926.0 secs
Computing kpt #: 124
total cpu time spent up to now is 932.3 secs
Computing kpt #: 125
total cpu time spent up to now is 938.5 secs
Computing kpt #: 126
total cpu time spent up to now is 944.8 secs
Computing kpt #: 127
total cpu time spent up to now is 951.3 secs
Computing kpt #: 128
total cpu time spent up to now is 957.4 secs
Computing kpt #: 129
total cpu time spent up to now is 963.8 secs
Computing kpt #: 130
total cpu time spent up to now is 970.1 secs
Computing kpt #: 131
total cpu time spent up to now is 976.4 secs
Computing kpt #: 132
total cpu time spent up to now is 982.7 secs
Computing kpt #: 133
total cpu time spent up to now is 989.2 secs
Computing kpt #: 134
total cpu time spent up to now is 995.6 secs
Computing kpt #: 135
total cpu time spent up to now is 1001.9 secs
Computing kpt #: 136
total cpu time spent up to now is 1008.4 secs
Computing kpt #: 137
total cpu time spent up to now is 1014.8 secs
Computing kpt #: 138
total cpu time spent up to now is 1021.4 secs
Computing kpt #: 139
total cpu time spent up to now is 1027.7 secs
Computing kpt #: 140
total cpu time spent up to now is 1034.1 secs
Computing kpt #: 141
total cpu time spent up to now is 1040.4 secs
Computing kpt #: 142
total cpu time spent up to now is 1046.8 secs
Computing kpt #: 143
total cpu time spent up to now is 1053.1 secs
Computing kpt #: 144
total cpu time spent up to now is 1059.5 secs
Computing kpt #: 145
total cpu time spent up to now is 1065.9 secs
Computing kpt #: 146
total cpu time spent up to now is 1072.4 secs
Computing kpt #: 147
total cpu time spent up to now is 1078.8 secs
Computing kpt #: 148
total cpu time spent up to now is 1085.2 secs
Computing kpt #: 149
total cpu time spent up to now is 1091.8 secs
Computing kpt #: 150
total cpu time spent up to now is 1098.5 secs
Computing kpt #: 151
total cpu time spent up to now is 1105.1 secs
Computing kpt #: 152
total cpu time spent up to now is 1112.1 secs
Computing kpt #: 153
total cpu time spent up to now is 1118.8 secs
Computing kpt #: 154
total cpu time spent up to now is 1125.5 secs
Computing kpt #: 155
total cpu time spent up to now is 1132.4 secs
Computing kpt #: 156
total cpu time spent up to now is 1141.9 secs
Computing kpt #: 157
total cpu time spent up to now is 1149.4 secs
Computing kpt #: 158
total cpu time spent up to now is 1156.8 secs
Computing kpt #: 159
total cpu time spent up to now is 1164.6 secs
Computing kpt #: 160
total cpu time spent up to now is 1172.8 secs
Computing kpt #: 161
total cpu time spent up to now is 1180.4 secs
Computing kpt #: 162
total cpu time spent up to now is 1188.0 secs
Computing kpt #: 163
total cpu time spent up to now is 1195.5 secs
Computing kpt #: 164
total cpu time spent up to now is 1203.2 secs
Computing kpt #: 165
total cpu time spent up to now is 1210.7 secs
Computing kpt #: 166
total cpu time spent up to now is 1218.7 secs
Computing kpt #: 167
total cpu time spent up to now is 1226.3 secs
Computing kpt #: 168
total cpu time spent up to now is 1234.1 secs
Computing kpt #: 169
total cpu time spent up to now is 1241.9 secs
Computing kpt #: 170
total cpu time spent up to now is 1249.9 secs
Computing kpt #: 171
total cpu time spent up to now is 1257.8 secs
Computing kpt #: 172
total cpu time spent up to now is 1265.9 secs
Computing kpt #: 173
total cpu time spent up to now is 1273.5 secs
Computing kpt #: 174
total cpu time spent up to now is 1280.9 secs
Computing kpt #: 175
total cpu time spent up to now is 1288.3 secs
Computing kpt #: 176
total cpu time spent up to now is 1295.4 secs
Computing kpt #: 177
total cpu time spent up to now is 1302.7 secs
Computing kpt #: 178
total cpu time spent up to now is 1310.1 secs
Computing kpt #: 179
total cpu time spent up to now is 1317.9 secs
Computing kpt #: 180
total cpu time spent up to now is 1325.3 secs
Computing kpt #: 181
total cpu time spent up to now is 1332.8 secs
Computing kpt #: 182
total cpu time spent up to now is 1340.7 secs
Computing kpt #: 183
total cpu time spent up to now is 1348.8 secs
Computing kpt #: 184
total cpu time spent up to now is 1356.8 secs
Computing kpt #: 185
total cpu time spent up to now is 1365.0 secs
Computing kpt #: 186
total cpu time spent up to now is 1372.9 secs
Computing kpt #: 187
total cpu time spent up to now is 1381.0 secs
Computing kpt #: 188
total cpu time spent up to now is 1389.0 secs
Computing kpt #: 189
total cpu time spent up to now is 1397.1 secs
Computing kpt #: 190
total cpu time spent up to now is 1405.3 secs
Computing kpt #: 191
total cpu time spent up to now is 1413.5 secs
Computing kpt #: 192
total cpu time spent up to now is 1421.9 secs
Computing kpt #: 193
total cpu time spent up to now is 1429.8 secs
Computing kpt #: 194
total cpu time spent up to now is 1439.0 secs
Computing kpt #: 195
total cpu time spent up to now is 1448.1 secs
Computing kpt #: 196
total cpu time spent up to now is 1455.9 secs
Computing kpt #: 197
total cpu time spent up to now is 1463.9 secs
Computing kpt #: 198
total cpu time spent up to now is 1471.7 secs
Computing kpt #: 199
total cpu time spent up to now is 1479.8 secs
Computing kpt #: 200
total cpu time spent up to now is 1487.6 secs
Computing kpt #: 201
total cpu time spent up to now is 1495.9 secs
Computing kpt #: 202
total cpu time spent up to now is 1503.9 secs
Computing kpt #: 203
total cpu time spent up to now is 1511.9 secs
Computing kpt #: 204
total cpu time spent up to now is 1519.8 secs
Computing kpt #: 205
total cpu time spent up to now is 1527.6 secs
Computing kpt #: 206
total cpu time spent up to now is 1535.5 secs
Computing kpt #: 207
total cpu time spent up to now is 1543.4 secs
Computing kpt #: 208
total cpu time spent up to now is 1551.4 secs
Computing kpt #: 209
total cpu time spent up to now is 1559.8 secs
Computing kpt #: 210
total cpu time spent up to now is 1567.7 secs
Computing kpt #: 211
total cpu time spent up to now is 1575.6 secs
Computing kpt #: 212
total cpu time spent up to now is 1583.9 secs
Computing kpt #: 213
total cpu time spent up to now is 1591.8 secs
Computing kpt #: 214
total cpu time spent up to now is 1599.7 secs
Computing kpt #: 215
total cpu time spent up to now is 1607.7 secs
Computing kpt #: 216
total cpu time spent up to now is 1615.8 secs
Computing kpt #: 217
total cpu time spent up to now is 1623.7 secs
Computing kpt #: 218
total cpu time spent up to now is 1631.8 secs
Computing kpt #: 219
total cpu time spent up to now is 1639.7 secs
Computing kpt #: 220
total cpu time spent up to now is 1647.6 secs
Computing kpt #: 221
total cpu time spent up to now is 1655.6 secs
Computing kpt #: 222
total cpu time spent up to now is 1663.5 secs
Computing kpt #: 223
total cpu time spent up to now is 1671.3 secs
Computing kpt #: 224
total cpu time spent up to now is 1679.0 secs
Computing kpt #: 225
total cpu time spent up to now is 1686.8 secs
Computing kpt #: 226
total cpu time spent up to now is 1694.8 secs
Computing kpt #: 227
total cpu time spent up to now is 1702.6 secs
Computing kpt #: 228
total cpu time spent up to now is 1710.5 secs
Computing kpt #: 229
total cpu time spent up to now is 1718.7 secs
Computing kpt #: 230
total cpu time spent up to now is 1726.6 secs
Computing kpt #: 231
total cpu time spent up to now is 1734.4 secs
Computing kpt #: 232
total cpu time spent up to now is 1744.3 secs
Computing kpt #: 233
total cpu time spent up to now is 1751.4 secs
Computing kpt #: 234
total cpu time spent up to now is 1758.4 secs
Computing kpt #: 235
total cpu time spent up to now is 1765.3 secs
Computing kpt #: 236
total cpu time spent up to now is 1772.0 secs
Computing kpt #: 237
total cpu time spent up to now is 1778.7 secs
Computing kpt #: 238
total cpu time spent up to now is 1785.4 secs
Computing kpt #: 239
total cpu time spent up to now is 1792.1 secs
Computing kpt #: 240
total cpu time spent up to now is 1798.7 secs
Computing kpt #: 241
total cpu time spent up to now is 1805.2 secs
Computing kpt #: 242
total cpu time spent up to now is 1812.0 secs
Computing kpt #: 243
total cpu time spent up to now is 1818.5 secs
Computing kpt #: 244
total cpu time spent up to now is 1825.0 secs
Computing kpt #: 245
total cpu time spent up to now is 1831.5 secs
Computing kpt #: 246
total cpu time spent up to now is 1837.8 secs
Computing kpt #: 247
total cpu time spent up to now is 1844.4 secs
Computing kpt #: 248
total cpu time spent up to now is 1850.7 secs
Computing kpt #: 249
total cpu time spent up to now is 1857.1 secs
Computing kpt #: 250
total cpu time spent up to now is 1863.8 secs
Computing kpt #: 251
total cpu time spent up to now is 1870.2 secs
Computing kpt #: 252
total cpu time spent up to now is 1876.6 secs
Computing kpt #: 253
total cpu time spent up to now is 1882.9 secs
Computing kpt #: 254
total cpu time spent up to now is 1890.2 secs
Computing kpt #: 255
total cpu time spent up to now is 1898.0 secs
Computing kpt #: 256
total cpu time spent up to now is 1905.2 secs
Computing kpt #: 257
total cpu time spent up to now is 1912.7 secs
Computing kpt #: 258
total cpu time spent up to now is 1920.3 secs
Computing kpt #: 259
total cpu time spent up to now is 1927.7 secs
Computing kpt #: 260
total cpu time spent up to now is 1935.7 secs
Computing kpt #: 261
total cpu time spent up to now is 1943.4 secs
Computing kpt #: 262
total cpu time spent up to now is 1951.2 secs
Computing kpt #: 263
total cpu time spent up to now is 1959.2 secs
Computing kpt #: 264
total cpu time spent up to now is 1967.2 secs
Computing kpt #: 265
total cpu time spent up to now is 1975.2 secs
Computing kpt #: 266
total cpu time spent up to now is 1983.5 secs
Computing kpt #: 267
total cpu time spent up to now is 1991.3 secs
Computing kpt #: 268
total cpu time spent up to now is 1999.2 secs
ethr = 1.61E-11, avg # of iterations = 36.9
total cpu time spent up to now is 1999.4 secs
End of band structure calculation
k = 0.0000 0.0000 0.0000 ( 7209 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1915 -7.1915 -5.9924 -5.9924 -5.8789 -5.8789
-5.8639 -5.8639 -1.1799 -1.1799 -1.1033 -1.1033 -0.9456 -0.9456
-0.8182 -0.8182 -0.5258 -0.5258 0.3853 0.3853 0.6079 0.6079
0.7629 0.7629 0.9318 0.9318 0.9769 0.9769 0.9884 0.9884
1.6564 1.6564 2.3515 2.3515 2.9775 2.9775 3.0969 3.0969
3.1993 3.1993 4.4057 4.4057 4.5831 4.5831 4.6108 4.6108
6.0745 6.0745 6.3687 6.3687 6.5007 6.5007 6.7544 6.7544
8.6909 8.6909 9.2018 9.2018 9.6517 9.6517 10.5152 10.5152
10.8268 10.8268
k = 0.0000 0.0000 0.0222 ( 7237 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1909 -7.1908 -5.9927 -5.9921 -5.8795 -5.8793
-5.8645 -5.8642 -1.1814 -1.1783 -1.1047 -1.1016 -0.9529 -0.9381
-0.8195 -0.8168 -0.5380 -0.5137 0.3824 0.3886 0.6049 0.6105
0.7611 0.7641 0.9286 0.9331 0.9704 0.9752 0.9852 1.0021
1.6535 1.6603 2.3462 2.3524 2.9581 2.9932 3.0798 3.1168
3.2033 3.2041 4.3857 4.4220 4.5616 4.5930 4.6127 4.6242
6.0657 6.0755 6.3531 6.3606 6.4802 6.4813 6.7846 6.7893
8.6920 8.6976 9.2029 9.2085 9.6477 9.6506 10.5118 10.5200
10.8243 10.8293
k = 0.0000 0.0000 0.0444 ( 7257 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1889 -7.1887 -5.9930 -5.9919 -5.8810 -5.8807
-5.8662 -5.8656 -1.1827 -1.1767 -1.1057 -1.0997 -0.9598 -0.9304
-0.8207 -0.8152 -0.5499 -0.5016 0.3800 0.3923 0.6015 0.6126
0.7585 0.7645 0.9234 0.9321 0.9612 0.9724 0.9896 1.0176
1.6518 1.6650 2.3370 2.3487 2.9386 2.9971 3.0756 3.1349
3.2151 3.2171 4.3651 4.4303 4.5407 4.5890 4.6191 4.6552
6.0484 6.0676 6.3105 6.3230 6.4492 6.4528 6.8562 6.8642
8.7005 8.7120 9.2119 9.2232 9.6386 9.6444 10.5100 10.5261
10.8219 10.8320
k = 0.0000 0.0000 0.0666 ( 7271 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1854 -7.1853 -5.9934 -5.9918 -5.8835 -5.8830
-5.8688 -5.8679 -1.1837 -1.1752 -1.1062 -1.0977 -0.9663 -0.9225
-0.8219 -0.8133 -0.5615 -0.4899 0.3779 0.3965 0.5978 0.6143
0.7551 0.7643 0.9158 0.9288 0.9556 0.9706 0.9950 1.0332
1.6514 1.6703 2.3242 2.3404 2.9205 2.9860 3.0887 3.1515
3.2310 3.2384 4.3458 4.4290 4.5187 4.5810 4.6345 4.6923
6.0197 6.0463 6.2481 6.2624 6.4290 6.4380 6.9433 6.9537
8.7153 8.7333 9.2293 9.2464 9.6248 9.6332 10.5098 10.5332
10.8195 10.8349
k = 0.0000 0.0000 0.0888 ( 7271 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1807 -7.1805 -5.9939 -5.9918 -5.8870 -5.8863
-5.8723 -5.8712 -1.1844 -1.1740 -1.1061 -1.0957 -0.9725 -0.9145
-0.8230 -0.8110 -0.5726 -0.4786 0.3762 0.4012 0.5937 0.6155
0.7511 0.7635 0.9064 0.9242 0.9533 0.9699 1.0005 1.0481
1.6521 1.6759 2.3082 2.3278 2.9046 2.9691 3.1110 3.1688
3.2502 3.2634 4.3286 4.4206 4.4937 4.5695 4.6616 4.7333
5.9748 6.0038 6.1868 6.2002 6.4160 6.4302 7.0360 7.0483
8.7347 8.7598 9.2556 9.2786 9.6068 9.6175 10.5111 10.5410
10.8172 10.8381
k = 0.0000 0.0000 0.1110 ( 7271 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1746 -7.1743 -5.9945 -5.9919 -5.8914 -5.8905
-5.8767 -5.8754 -1.1845 -1.1732 -1.1054 -1.0937 -0.9783 -0.9066
-0.8241 -0.8083 -0.5830 -0.4679 0.3749 0.4063 0.5894 0.6162
0.7463 0.7621 0.8965 0.9194 0.9526 0.9700 1.0060 1.0620
1.6539 1.6812 2.2896 2.3111 2.8917 2.9527 3.1364 3.1885
3.2721 3.2891 4.3141 4.4085 4.4672 4.5557 4.6977 4.7772
5.9104 5.9355 6.1374 6.1503 6.4054 6.4243 7.1307 7.1446
8.7569 8.7896 9.2916 9.3203 9.5852 9.5977 10.5139 10.5493
10.8152 10.8418
k = 0.0000 0.0000 0.1333 ( 7285 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7617 -14.7616 -14.7161 -14.7161
-14.7095 -14.7094 -7.1672 -7.1668 -5.9952 -5.9921 -5.8967 -5.8957
-5.8818 -5.8804 -1.1843 -1.1728 -1.1039 -1.0917 -0.9837 -0.8988
-0.8253 -0.8049 -0.5927 -0.4580 0.3738 0.4118 0.5848 0.6165
0.7409 0.7600 0.8871 0.9146 0.9527 0.9710 1.0113 1.0744
1.6563 1.6859 2.2688 2.2909 2.8825 2.9395 3.1610 3.2115
3.2958 3.3139 4.3020 4.3936 4.4427 4.5418 4.7399 4.8236
5.8290 5.8483 6.0958 6.1140 6.3954 6.4183 7.2257 7.2410
8.7802 8.8205 9.3376 9.3715 9.5608 9.5744 10.5180 10.5578
10.8137 10.8461
k = 0.0000 0.0000 0.1555 ( 7293 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7617 -14.7616 -14.7161 -14.7161
-14.7095 -14.7094 -7.1585 -7.1581 -5.9960 -5.9927 -5.9028 -5.9018
-5.8875 -5.8862 -1.1835 -1.1729 -1.1018 -1.0898 -0.9887 -0.8914
-0.8266 -0.8008 -0.6015 -0.4490 0.3731 0.4178 0.5801 0.6164
0.7349 0.7574 0.8785 0.9101 0.9531 0.9727 1.0161 1.0849
1.6592 1.6894 2.2460 2.2678 2.8776 2.9310 3.1805 3.2392
3.3187 3.3396 4.2924 4.3755 4.4249 4.5302 4.7863 4.8720
5.7368 5.7516 6.0580 6.0830 6.3855 6.4116 7.3202 7.3364
8.8033 8.8507 9.3920 9.4315 9.5354 9.5492 10.5232 10.5664
10.8127 10.8510
k = 0.0000 0.0000 0.1777 ( 7291 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7546 -14.7617 -14.7616 -14.7161 -14.7161
-14.7095 -14.7094 -7.1485 -7.1480 -5.9971 -5.9935 -5.9097 -5.9086
-5.8939 -5.8926 -1.1823 -1.1734 -1.0991 -1.0879 -0.9932 -0.8845
-0.8280 -0.7958 -0.6094 -0.4409 0.3727 0.4241 0.5752 0.6159
0.7287 0.7542 0.8710 0.9059 0.9537 0.9749 1.0205 1.0933
1.6618 1.6915 2.2215 2.2426 2.8775 2.9281 3.1919 3.2713
3.3364 3.3707 4.2850 4.3552 4.4157 4.5225 4.8356 4.9220
5.6386 5.6509 6.0210 6.0516 6.3752 6.4040 7.4136 7.4302
8.8253 8.8786 9.4436 9.4939 9.5162 9.5318 10.5296 10.5752
10.8126 10.8567
k = 0.0000 0.0000 0.1999 ( 7293 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7617 -14.7616 -14.7161 -14.7161
-14.7095 -14.7094 -7.1373 -7.1367 -5.9986 -5.9949 -5.9173 -5.9162
-5.9008 -5.8995 -1.1806 -1.1743 -1.0960 -1.0859 -0.9973 -0.8783
-0.8296 -0.7900 -0.6160 -0.4340 0.3725 0.4309 0.5703 0.6151
0.7223 0.7504 0.8646 0.9021 0.9545 0.9776 1.0244 1.0996
1.6636 1.6915 2.1954 2.2158 2.8829 2.9317 3.1942 3.3023
3.3519 3.4083 4.2800 4.3364 4.4142 4.5200 4.8869 4.9731
5.5374 5.5492 5.9827 6.0176 6.3644 6.3955 7.5054 7.5221
8.8455 8.9034 9.4487 9.4799 9.5673 9.5788 10.5370 10.5842
10.8136 10.8634
k = 0.0000 0.0000 0.2221 ( 7289 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7095 -14.7094 -7.1250 -7.1242 -6.0005 -5.9967 -5.9255 -5.9243
-5.9082 -5.9069 -1.1785 -1.1754 -1.0928 -1.0837 -1.0009 -0.8726
-0.8313 -0.7834 -0.6215 -0.4283 0.3725 0.4380 0.5652 0.6140
0.7159 0.7463 0.8592 0.8986 0.9554 0.9807 1.0277 1.1037
1.6639 1.6891 2.1677 2.1882 2.8939 2.9422 3.1880 3.3166
3.3798 3.4510 4.2780 4.3220 4.4194 4.5228 4.9396 5.0249
5.4351 5.4483 5.9418 5.9801 6.3532 6.3860 7.5953 7.6117
8.8634 8.9247 9.4223 9.4475 9.6453 9.6576 10.5455 10.5937
10.8160 10.8711
k = 0.0000 0.0000 0.2443 ( 7289 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7095 -14.7094 -7.1114 -7.1106 -6.0031 -5.9993 -5.9340 -5.9325
-5.9160 -5.9147 -1.1770 -1.1758 -1.0900 -1.0808 -1.0040 -0.8677
-0.8331 -0.7763 -0.6254 -0.4237 0.3728 0.4453 0.5602 0.6128
0.7097 0.7417 0.8547 0.8954 0.9565 0.9840 1.0304 1.1056
1.6622 1.6841 2.1383 2.1603 2.9108 2.9600 3.1744 3.3113
3.4229 3.4978 4.2799 4.3135 4.4304 4.5306 4.9928 5.0763
5.3332 5.3504 5.8980 5.9385 6.3415 6.3756 7.6831 7.6988
8.8789 8.9424 9.3900 9.4127 9.7326 9.7403 10.5552 10.6043
10.8201 10.8800
k = 0.0000 0.0000 0.2665 ( 7297 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7094 -14.7094 -7.0968 -7.0959 -6.0066 -6.0028 -5.9429 -5.9406
-5.9242 -5.9228 -1.1783 -1.1731 -1.0879 -1.0771 -1.0066 -0.8634
-0.8350 -0.7690 -0.6278 -0.4204 0.3732 0.4529 0.5551 0.6114
0.7038 0.7369 0.8508 0.8925 0.9578 0.9876 1.0324 1.1055
1.6579 1.6763 2.1076 2.1324 2.9335 2.9851 3.1551 3.2948
3.4727 3.5477 4.2860 4.3115 4.4461 4.5429 5.0456 5.1240
5.2336 5.2601 5.8507 5.8930 6.3292 6.3642 7.7685 7.7830
8.8913 8.9561 9.3559 9.3765 9.8187 9.8281 10.5661 10.6164
10.8260 10.8900
k = 0.0000 0.0000 0.2887 ( 7295 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7094 -14.7094 -7.0812 -7.0801 -6.0114 -6.0073 -5.9518 -5.9484
-5.9325 -5.9310 -1.1798 -1.1700 -1.0864 -1.0725 -1.0086 -0.8596
-0.8369 -0.7619 -0.6283 -0.4184 0.3739 0.4606 0.5501 0.6100
0.6984 0.7319 0.8476 0.8897 0.9592 0.9912 1.0339 1.1036
1.6505 1.6658 2.0756 2.1045 2.9611 3.0172 3.1327 3.2714
3.5258 3.6001 4.2965 4.3157 4.4655 4.5585 5.0904 5.1267
5.1509 5.2139 5.8000 5.8435 6.3162 6.3520 7.8515 7.8643
8.9000 8.9656 9.3211 9.3398 9.8991 9.9193 10.5782 10.6308
10.8341 10.9013
k = 0.0000 0.0000 0.3109 ( 7303 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7094 -14.7094 -7.0646 -7.0633 -6.0177 -6.0130 -5.9604 -5.9558
-5.9410 -5.9391 -1.1812 -1.1667 -1.0855 -1.0675 -1.0099 -0.8563
-0.8388 -0.7555 -0.6269 -0.4176 0.3747 0.4684 0.5452 0.6084
0.6937 0.7267 0.8448 0.8870 0.9608 0.9948 1.0348 1.1000
1.6396 1.6528 2.0427 2.0766 2.9907 3.0544 3.1129 3.2439
3.5807 3.6538 4.3110 4.3258 4.4866 4.5763 5.0401 5.0561
5.1651 5.2503 5.7461 5.7903 6.3027 6.3388 7.9317 7.9425
8.9037 8.9703 9.2862 9.3035 9.9747 10.0080 10.5916 10.6482
10.8445 10.9136
k = 0.0000 0.0000 0.3331 ( 7307 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7094 -14.7094 -7.0471 -7.0457 -6.0256 -6.0200 -5.9686 -5.9631
-5.9495 -5.9468 -1.1826 -1.1633 -1.0848 -1.0624 -1.0105 -0.8537
-0.8403 -0.7503 -0.6232 -0.4180 0.3756 0.4761 0.5405 0.6069
0.6896 0.7216 0.8424 0.8844 0.9625 0.9982 1.0351 1.0950
1.6254 1.6373 2.0092 2.0483 3.0120 3.0829 3.1192 3.2163
3.6357 3.7076 4.3283 4.3410 4.5073 4.5942 4.9557 4.9871
5.2152 5.3000 5.6892 5.7339 6.2883 6.3247 8.0091 8.0175
8.9011 8.9697 9.2509 9.2694 10.0443 10.0911 10.6064 10.6688
10.8573 10.9270
k = 0.0000 0.0000 0.3554 ( 7303 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7094 -14.7093 -7.0288 -7.0271 -6.0348 -6.0284 -5.9764 -5.9706
-5.9576 -5.9537 -1.1838 -1.1599 -1.0843 -1.0572 -1.0101 -0.8520
-0.8411 -0.7465 -0.6175 -0.4195 0.3768 0.4838 0.5360 0.6053
0.6863 0.7166 0.8402 0.8818 0.9643 1.0011 1.0350 1.0890
1.6082 1.6195 1.9751 2.0196 3.0082 3.1008 3.1626 3.1994
3.6890 3.7596 4.3475 4.3606 4.5245 4.6089 4.8832 4.9289
5.2670 5.3507 5.6298 5.6749 6.2733 6.3097 8.0834 8.0893
8.8905 8.9627 9.2156 9.2385 10.1069 10.1665 10.6226 10.6925
10.8726 10.9410
k = 0.0000 0.0000 0.3776 ( 7303 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7094 -14.7093 -7.0097 -7.0079 -6.0452 -6.0380 -5.9841 -5.9787
-5.9652 -5.9597 -1.1847 -1.1565 -1.0839 -1.0524 -1.0087 -0.8519
-0.8404 -0.7441 -0.6098 -0.4220 0.3780 0.4912 0.5317 0.6038
0.6837 0.7118 0.8382 0.8792 0.9663 1.0032 1.0345 1.0822
1.5884 1.5994 1.9406 1.9903 2.9891 3.1053 3.1996 3.2315
3.7381 3.8070 4.3672 4.3837 4.5353 4.6144 4.8316 4.8895
5.3178 5.4002 5.5689 5.6139 6.2574 6.2938 8.1542 8.1582
8.8706 8.9481 9.1814 9.2111 10.1622 10.2329 10.6404 10.7182
10.8901 10.9555
k = 0.0000 0.0000 0.3998 ( 7311 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7094 -14.7093 -6.9899 -6.9879 -6.0563 -6.0487 -5.9920 -5.9874
-5.9720 -5.9648 -1.1855 -1.1532 -1.0836 -1.0481 -1.0060 -0.8529
-0.8385 -0.7432 -0.6005 -0.4254 0.3794 0.4983 0.5279 0.6023
0.6818 0.7074 0.8363 0.8765 0.9682 1.0041 1.0338 1.0750
1.5668 1.5771 1.9059 1.9604 2.9679 3.0870 3.2467 3.2942
3.7793 3.8460 4.3859 4.4094 4.5401 4.6058 4.8098 4.8722
5.3665 5.4431 5.5120 5.5526 6.2407 6.2769 8.2202 8.2252
8.8410 8.9241 9.1498 9.1862 10.2105 10.2903 10.6597 10.7446
10.9094 10.9705
k = 0.0000 0.0000 0.4220 ( 7305 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7618 -14.7161 -14.7161
-14.7094 -14.7093 -6.9696 -6.9673 -6.0680 -6.0602 -6.0004 -5.9965
-5.9780 -5.9694 -1.1859 -1.1500 -1.0833 -1.0446 -1.0020 -0.8546
-0.8360 -0.7436 -0.5901 -0.4295 0.3809 0.5047 0.5246 0.6009
0.6806 0.7033 0.8346 0.8737 0.9700 1.0034 1.0327 1.0680
1.5440 1.5529 1.8712 1.9298 2.9490 3.0635 3.3062 3.3637
3.8079 3.8715 4.4029 4.4378 4.5444 4.5893 4.8162 4.8749
5.4089 5.4268 5.4949 5.5128 6.2231 6.2590 8.2815 8.2901
8.8021 8.8897 9.1214 9.1625 10.2529 10.3396 10.6804 10.7702
10.9295 10.9864
k = 0.0000 0.0000 0.4442 ( 7297 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7618 -14.7161 -14.7161
-14.7094 -14.7093 -6.9487 -6.9463 -6.0799 -6.0721 -6.0092 -6.0059
-5.9833 -5.9737 -1.1861 -1.1470 -1.0830 -1.0418 -0.9967 -0.8565
-0.8331 -0.7450 -0.5790 -0.4341 0.3825 0.5098 0.5226 0.5996
0.6799 0.7000 0.8328 0.8709 0.9716 1.0007 1.0313 1.0615
1.5199 1.5278 1.8367 1.8986 2.9343 3.0417 3.3722 3.4376
3.8192 3.8787 4.4203 4.4699 4.5551 4.5788 4.8397 4.8915
5.3662 5.4068 5.4817 5.5554 6.2047 6.2401 8.3385 8.3518
8.7554 8.8452 9.0951 9.1387 10.2905 10.3824 10.7023 10.7944
10.9494 11.0040
k = 0.0000 0.0000 0.4664 ( 7309 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7618 -14.7161 -14.7161
-14.7094 -14.7093 -6.9276 -6.9249 -6.0919 -6.0842 -6.0183 -6.0154
-5.9883 -5.9780 -1.1859 -1.1441 -1.0826 -1.0398 -0.9904 -0.8584
-0.8301 -0.7475 -0.5677 -0.4391 0.3842 0.5123 0.5231 0.5985
0.6794 0.6975 0.8311 0.8680 0.9728 0.9958 1.0292 1.0559
1.4940 1.5032 1.8029 1.8669 2.9244 3.0238 3.4422 3.5146
3.8104 3.8649 4.4432 4.5084 4.5736 4.5813 4.8720 4.9165
5.3031 5.3550 5.5184 5.6006 6.1853 6.2203 8.3908 8.4101
8.7024 8.7918 9.0687 9.1133 10.3246 10.4203 10.7251 10.8172
10.9680 11.0241
k = 0.0000 0.0000 0.4886 ( 7307 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7618 -14.7161 -14.7161
-14.7094 -14.7093 -6.9061 -6.9032 -6.1038 -6.0963 -6.0275 -6.0249
-5.9931 -5.9823 -1.1853 -1.1414 -1.0822 -1.0383 -0.9832 -0.8602
-0.8270 -0.7508 -0.5567 -0.4441 0.3860 0.5119 0.5264 0.5976
0.6789 0.6962 0.8294 0.8651 0.9735 0.9887 1.0261 1.0515
1.4662 1.4803 1.7701 1.8352 2.9198 3.0110 3.5144 3.5935
3.7831 3.8321 4.4745 4.5546 4.5928 4.6002 4.9083 4.9456
5.2424 5.3016 5.5596 5.6449 6.1650 6.1995 8.4362 8.4642
8.6466 8.7316 9.0403 9.0854 10.3565 10.4551 10.7483 10.8391
10.9856 11.0462
k = 0.0000 0.0000 0.5108 ( 7303 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7618 -14.7161 -14.7161
-14.7094 -14.7093 -6.8845 -6.8814 -6.1155 -6.1082 -6.0366 -6.0342
-5.9980 -5.9869 -1.1844 -1.1389 -1.0816 -1.0372 -0.9756 -0.8620
-0.8238 -0.7549 -0.5462 -0.4489 0.3879 0.5108 0.5304 0.5969
0.6782 0.6961 0.8276 0.8622 0.9733 0.9799 1.0221 1.0479
1.4375 1.4592 1.7388 1.8036 2.9204 3.0037 3.5864 3.6715
3.7430 3.7858 4.5124 4.5994 4.6193 4.6312 4.9451 4.9757
5.1882 5.2559 5.5996 5.6878 6.1438 6.1778 8.4658 8.5122
8.5971 8.6680 9.0080 9.0545 10.3873 10.4881 10.7717 10.8608
11.0030 11.0695
k = 0.0000 0.0000 0.5330 ( 7305 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7618 -14.7161 -14.7161
-14.7094 -14.7093 -6.8629 -6.8596 -6.1269 -6.1199 -6.0456 -6.0433
-6.0029 -5.9917 -1.1831 -1.1366 -1.0808 -1.0363 -0.9677 -0.8635
-0.8208 -0.7596 -0.5368 -0.4532 0.3900 0.5099 0.5340 0.5964
0.6775 0.6971 0.8258 0.8593 0.9684 0.9731 1.0172 1.0446
1.4089 1.4399 1.7094 1.7726 2.9263 3.0021 3.6457 3.6979
3.7221 3.7648 4.5507 4.6191 4.6635 4.6797 4.9771 5.0036
5.1478 5.2243 5.6376 5.7290 6.1218 6.1553 8.4511 8.5418
8.5758 8.6216 8.9709 9.0204 10.4179 10.5202 10.7949 10.8828
11.0210 11.0929
k = 0.0000 0.0000 0.5552 ( 7297 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.8414 -6.8379 -6.1378 -6.1311 -6.0544 -6.0522
-6.0080 -5.9968 -1.1815 -1.1345 -1.0799 -1.0357 -0.9597 -0.8648
-0.8178 -0.7650 -0.5288 -0.4564 0.3922 0.5094 0.5372 0.5960
0.6769 0.6989 0.8238 0.8564 0.9567 0.9705 1.0116 1.0411
1.3810 1.4226 1.6824 1.7427 2.9372 3.0062 3.6198 3.6574
3.7465 3.8356 4.5813 4.6298 4.7048 4.7446 4.9949 5.0251
5.1351 5.2140 5.6732 5.7682 6.0990 6.1322 8.3929 8.4944
8.5952 8.6384 8.9285 8.9837 10.4491 10.5521 10.8176 10.9052
11.0398 11.1159
k = 0.0000 0.0000 0.5775 ( 7321 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.8203 -6.8166 -6.1481 -6.1419 -6.0629 -6.0608
-6.0132 -6.0022 -1.1794 -1.1326 -1.0788 -1.0353 -0.9517 -0.8659
-0.8151 -0.7709 -0.5225 -0.4584 0.3947 0.5094 0.5397 0.5957
0.6767 0.7013 0.8217 0.8536 0.9436 0.9669 1.0054 1.0373
1.3548 1.4074 1.6579 1.7143 2.9528 3.0159 3.5623 3.5941
3.8107 3.9077 4.5972 4.6338 4.7507 4.8106 4.9976 5.0396
5.1569 5.2281 5.7062 5.8055 6.0755 6.1085 8.3196 8.4169
8.6229 8.6755 8.8807 8.9459 10.4813 10.5842 10.8395 10.9278
11.0592 11.1383
k = 0.0000 0.0000 0.5997 ( 7307 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.7995 -6.7957 -6.1578 -6.1520 -6.0711 -6.0689
-6.0187 -6.0079 -1.1770 -1.1308 -1.0775 -1.0350 -0.9440 -0.8667
-0.8128 -0.7772 -0.5181 -0.4589 0.3975 0.5099 0.5416 0.5956
0.6768 0.7039 0.8193 0.8507 0.9297 0.9618 0.9988 1.0330
1.3308 1.3941 1.6363 1.6878 2.9725 3.0309 3.5022 3.5298
3.8709 3.9723 4.5984 4.6310 4.7988 4.8728 5.0033 5.0541
5.1998 5.2622 5.7363 5.8403 6.0514 6.0847 8.2406 8.3334
8.6436 8.7139 8.8280 8.9104 10.5150 10.6165 10.8602 10.9501
11.0789 11.1604
k = 0.0000 0.0000 0.6219 ( 7323 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.7794 -6.7754 -6.1667 -6.1614 -6.0788 -6.0767
-6.0242 -6.0138 -1.1743 -1.1293 -1.0759 -1.0349 -0.9367 -0.8672
-0.8109 -0.7840 -0.5152 -0.4583 0.4006 0.5108 0.5428 0.5956
0.6774 0.7066 0.8167 0.8474 0.9152 0.9553 0.9920 1.0282
1.3099 1.3824 1.6176 1.6636 2.9957 3.0509 3.4429 3.4672
3.9211 4.0245 4.5922 4.6235 4.8457 4.9251 5.0262 5.0747
5.2528 5.3098 5.7634 5.8723 6.0273 6.0612 8.1588 8.2470
8.6508 8.7503 8.7712 8.8826 10.5502 10.6491 10.8795 10.9712
11.0983 11.1827
k = 0.0000 0.0000 0.6441 ( 7353 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.7600 -6.7560 -6.1749 -6.1701 -6.0861 -6.0840
-6.0299 -6.0199 -1.1713 -1.1281 -1.0741 -1.0350 -0.9296 -0.8675
-0.8096 -0.7911 -0.5133 -0.4569 0.4042 0.5120 0.5435 0.5958
0.6783 0.7092 0.8135 0.8436 0.9011 0.9476 0.9850 1.0230
1.2923 1.3721 1.6019 1.6421 3.0217 3.0754 3.3859 3.4087
3.9569 4.0586 4.5877 4.6176 4.8886 4.9641 5.0684 5.1038
5.3111 5.3661 5.7872 5.9003 6.0038 6.0390 8.0760 8.1592
8.6385 8.7107 8.7845 8.8689 10.5869 10.6818 10.8971 10.9904
11.1172 11.2054
k = 0.0000 0.0000 0.6663 ( 7335 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.7416 -6.7376 -6.1823 -6.1779 -6.0928 -6.0908
-6.0356 -6.0261 -1.1680 -1.1272 -1.0720 -1.0352 -0.9230 -0.8673
-0.8092 -0.7982 -0.5117 -0.4554 0.4083 0.5132 0.5439 0.5964
0.6794 0.7113 0.8097 0.8385 0.8883 0.9390 0.9781 1.0174
1.2783 1.3625 1.5891 1.6235 3.0488 3.1032 3.3327 3.3568
3.9741 4.0700 4.5923 4.6206 4.9263 4.9940 5.1214 5.1413
5.3722 5.4282 5.8072 5.9205 5.9833 6.0201 7.9936 8.0714
8.6069 8.6485 8.8157 8.8699 10.6249 10.7143 10.9128 11.0068
11.1354 11.2288
k = 0.0000 0.0000 0.6885 ( 7329 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.7243 -6.7205 -6.1888 -6.1849 -6.0990 -6.0970
-6.0411 -6.0323 -1.1646 -1.1266 -1.0696 -1.0356 -0.9168 -0.8669
-0.8099 -0.8050 -0.5099 -0.4542 0.4129 0.5139 0.5444 0.5974
0.6805 0.7128 0.8050 0.8317 0.8781 0.9299 0.9719 1.0115
1.2679 1.3533 1.5790 1.6079 3.0742 3.1318 3.2859 3.3150
3.9715 4.0580 4.6082 4.6365 4.9586 5.0188 5.1771 5.1861
5.4341 5.4930 5.8227 5.9241 5.9706 6.0099 7.9129 7.9849
8.5620 8.5858 8.8440 8.8802 10.6638 10.7464 10.9268 11.0203
11.1529 11.2527
k = 0.0000 0.0000 0.7107 ( 7321 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.7084 -6.7047 -6.1944 -6.1909 -6.1047 -6.1027
-6.0464 -6.0385 -1.1609 -1.1263 -1.0671 -1.0362 -0.9110 -0.8662
-0.8141 -0.8089 -0.5075 -0.4537 0.4182 0.5133 0.5458 0.5987
0.6816 0.7132 0.7991 0.8235 0.8713 0.9206 0.9665 1.0054
1.2610 1.3442 1.5715 1.5952 3.0923 3.1527 3.2544 3.2894
3.9509 4.0267 4.6340 4.6637 4.9860 5.0396 5.2314 5.2375
5.4946 5.5576 5.8329 5.9108 5.9616 6.0148 7.8357 7.9013
8.5105 8.5245 8.8692 8.8945 10.7030 10.7775 10.9394 11.0307
11.1693 11.2762
k = 0.0000 0.0000 0.7329 ( 7325 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6941 -6.6907 -6.1991 -6.1961 -6.1097 -6.1078
-6.0514 -6.0443 -1.1571 -1.1265 -1.0643 -1.0370 -0.9055 -0.8654
-0.8205 -0.8111 -0.5045 -0.4540 0.4241 0.5110 0.5485 0.6001
0.6824 0.7124 0.7924 0.8150 0.8673 0.9115 0.9624 0.9992
1.2571 1.3348 1.5662 1.5853 3.0962 3.1467 3.2576 3.2870
3.9164 3.9819 4.6661 4.6970 5.0089 5.0565 5.2841 5.2920
5.5513 5.6177 5.8371 5.8943 5.9523 6.0275 7.7635 7.8221
8.4566 8.4667 8.8913 8.9095 10.7417 10.8069 10.9514 11.0385
11.1842 11.2975
k = 0.0000 0.0000 0.7551 ( 7325 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6815 -6.6784 -6.2029 -6.2004 -6.1140 -6.1123
-6.0559 -6.0498 -1.1533 -1.1270 -1.0614 -1.0381 -0.9003 -0.8646
-0.8264 -0.8137 -0.5007 -0.4554 0.4306 0.5069 0.5528 0.6011
0.6830 0.7099 0.7858 0.8069 0.8653 0.9030 0.9596 0.9930
1.2559 1.3252 1.5627 1.5779 3.0859 3.1203 3.2884 3.3081
3.8727 3.9290 4.7007 4.7313 5.0279 5.0694 5.3363 5.3456
5.6013 5.6672 5.8359 5.8845 5.9455 6.0399 7.6985 7.7493
8.4043 8.4138 8.9103 8.9235 10.7786 10.8336 10.9635 11.0441
11.1973 11.3138
k = 0.0000 0.0000 0.7773 ( 7321 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6708 -6.6682 -6.2058 -6.2038 -6.1175 -6.1161
-6.0596 -6.0546 -1.1496 -1.1280 -1.0585 -1.0394 -0.8953 -0.8644
-0.8312 -0.8168 -0.4961 -0.4577 0.4378 0.5013 0.5585 0.6014
0.6834 0.7059 0.7804 0.7996 0.8649 0.8954 0.9583 0.9869
1.2571 1.3155 1.5608 1.5724 3.0691 3.0920 3.3283 3.3446
3.8238 3.8719 4.7344 4.7627 5.0436 5.0786 5.3864 5.3965
5.6407 5.6976 5.8334 5.8891 5.9411 6.0484 7.6424 7.6847
8.3572 8.3667 8.9260 8.9356 10.8123 10.8564 10.9770 11.0480
11.2087 11.3211
k = 0.0000 0.0000 0.7995 ( 7327 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6622 -6.6601 -6.2080 -6.2065 -6.1203 -6.1192
-6.0626 -6.0588 -1.1459 -1.1294 -1.0555 -1.0409 -0.8904 -0.8654
-0.8341 -0.8203 -0.4911 -0.4609 0.4455 0.4945 0.5651 0.6003
0.6837 0.7010 0.7771 0.7929 0.8657 0.8887 0.9585 0.9811
1.2603 1.3058 1.5600 1.5684 3.0526 3.0675 3.3716 3.3877
3.7737 3.8140 4.7646 4.7882 5.0565 5.0840 5.4324 5.4431
5.6647 5.7053 5.8369 5.9070 5.9403 6.0510 7.5976 7.6303
8.3183 8.3269 8.9385 8.9452 10.8409 10.8739 10.9927 11.0503
11.2191 11.3167
k = 0.0000 0.0000 0.8218 ( 7329 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7546 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6558 -6.6544 -6.2094 -6.2084 -6.1223 -6.1215
-6.0647 -6.0620 -1.1424 -1.1313 -1.0526 -1.0428 -0.8856 -0.8679
-0.8347 -0.8239 -0.4857 -0.4649 0.4535 0.4869 0.5724 0.5976
0.6844 0.6960 0.7759 0.7871 0.8674 0.8828 0.9599 0.9755
1.2652 1.2963 1.5601 1.5655 3.0398 3.0489 3.4149 3.4306
3.7273 3.7589 4.7891 4.8062 5.0668 5.0860 5.4719 5.4822
5.6725 5.6974 5.8502 5.9147 5.9563 6.0463 7.5657 7.5881
8.2897 8.2962 8.9478 8.9520 10.8633 10.8850 11.0101 11.0505
11.2298 11.3016
k = 0.0000 0.0000 0.8440 ( 7325 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7546 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6518 -6.6511 -6.2101 -6.2096 -6.1234 -6.1230
-6.0656 -6.0643 -1.1391 -1.1335 -1.0498 -1.0449 -0.8807 -0.8716
-0.8335 -0.8276 -0.4802 -0.4696 0.4619 0.4788 0.5799 0.5931
0.6858 0.6916 0.7765 0.7823 0.8701 0.8778 0.9625 0.9705
1.2714 1.2872 1.5607 1.5634 3.0324 3.0367 3.4527 3.4640
3.6933 3.7124 4.8064 4.8154 5.0751 5.0850 5.5015 5.5085
5.6717 5.6843 5.8695 5.9054 5.9858 6.0337 7.5482 7.5597
8.2727 8.2762 8.9537 8.9558 10.8788 10.8895 11.0266 11.0474
11.2431 11.2810
k = 0.0000 0.0000 0.8662 ( 7358 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7546 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6502 -6.6502 -6.2101 -6.2101 -6.1237 -6.1237
-6.0655 -6.0655 -1.1362 -1.1362 -1.0473 -1.0473 -0.8760 -0.8760
-0.8309 -0.8309 -0.4747 -0.4747 0.4704 0.4704 0.5870 0.5870
0.6882 0.6882 0.7787 0.7787 0.8735 0.8735 0.9661 0.9661
1.2789 1.2789 1.5619 1.5619 3.0312 3.0312 3.4733 3.4733
3.6863 3.6863 4.8154 4.8154 5.0812 5.0812 5.5155 5.5155
5.6740 5.6740 5.8893 5.8893 6.0131 6.0131 7.5462 7.5462
8.2681 8.2681 8.9564 8.9564 10.8875 10.8875 11.0396 11.0396
11.2603 11.2603
k = 0.0000 0.0000 0.8662 ( 7358 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7546 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6502 -6.6502 -6.2101 -6.2101 -6.1237 -6.1237
-6.0655 -6.0655 -1.1362 -1.1362 -1.0473 -1.0473 -0.8760 -0.8760
-0.8309 -0.8309 -0.4747 -0.4747 0.4704 0.4704 0.5870 0.5870
0.6882 0.6882 0.7787 0.7787 0.8735 0.8735 0.9661 0.9661
1.2789 1.2789 1.5619 1.5619 3.0312 3.0312 3.4733 3.4733
3.6863 3.6863 4.8154 4.8154 5.0812 5.0812 5.5155 5.5155
5.6740 5.6740 5.8893 5.8893 6.0131 6.0131 7.5462 7.5462
8.2681 8.2681 8.9564 8.9564 10.8875 10.8875 11.0396 11.0396
11.2603 11.2603
k =-0.0125 0.0177 0.8662 ( 7332 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7546 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6504 -6.6500 -6.2110 -6.2102 -6.1244 -6.1226
-6.0658 -6.0651 -1.1427 -1.1302 -1.0498 -1.0451 -0.8872 -0.8670
-0.8314 -0.8300 -0.4856 -0.4611 0.4623 0.4787 0.5836 0.5901
0.6779 0.6971 0.7716 0.7889 0.8684 0.8791 0.9633 0.9692
1.2744 1.2865 1.5593 1.5660 3.0309 3.0330 3.4706 3.4762
3.6849 3.6885 4.8023 4.8218 5.0666 5.0943 5.5099 5.5188
5.6617 5.6734 5.8740 5.9049 6.0061 6.0195 7.5456 7.5524
8.2704 8.2732 8.9534 8.9637 10.8843 10.8917 11.0367 11.0399
11.2509 11.2741
k =-0.0250 0.0353 0.8662 ( 7326 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6506 -6.6499 -6.2127 -6.2111 -6.1248 -6.1212
-6.0659 -6.0644 -1.1497 -1.1247 -1.0528 -1.0433 -0.8996 -0.8615
-0.8311 -0.8284 -0.4936 -0.4451 0.4546 0.4871 0.5801 0.5930
0.6675 0.7027 0.7696 0.8008 0.8638 0.8849 0.9608 0.9728
1.2732 1.2970 1.5582 1.5715 3.0320 3.0363 3.4680 3.4792
3.6843 3.6915 4.7831 4.8204 5.0517 5.1053 5.5018 5.5196
5.6383 5.6591 5.8611 5.9183 5.9989 6.0249 7.5507 7.5641
8.2800 8.2854 8.9547 8.9755 10.8809 10.8971 11.0305 11.0383
11.2459 11.2925
k =-0.0375 0.0530 0.8662 ( 7308 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6508 -6.6498 -6.2152 -6.2130 -6.1248 -6.1196
-6.0657 -6.0636 -1.1573 -1.1197 -1.0563 -1.0420 -0.9124 -0.8603
-0.8311 -0.8248 -0.4984 -0.4272 0.4474 0.4953 0.5766 0.5955
0.6577 0.7040 0.7737 0.8135 0.8598 0.8908 0.9585 0.9774
1.2754 1.3101 1.5589 1.5784 3.0346 3.0411 3.4655 3.4822
3.6845 3.6954 4.7586 4.8108 5.0372 5.1136 5.4910 5.5180
5.6060 5.6325 5.8507 5.9274 5.9915 6.0289 7.5617 7.5813
8.2965 8.3044 8.9597 8.9910 10.8755 10.9030 11.0208 11.0355
11.2450 11.3157
k =-0.0500 0.0707 0.8662 ( 7308 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6511 -6.6498 -6.2187 -6.2159 -6.1241 -6.1175
-6.0653 -6.0626 -1.1656 -1.1151 -1.0602 -1.0412 -0.9250 -0.8624
-0.8321 -0.8196 -0.5003 -0.4079 0.4407 0.5031 0.5731 0.5975
0.6491 0.7022 0.7825 0.8263 0.8564 0.8962 0.9568 0.9834
1.2812 1.3257 1.5612 1.5868 3.0386 3.0473 3.4632 3.4852
3.6856 3.6999 4.7294 4.7928 5.0240 5.1190 5.4767 5.5137
5.5679 5.5962 5.8415 5.9312 5.9837 6.0310 7.5785 7.6038
8.3194 8.3296 8.9676 9.0096 10.8655 10.9070 11.0080 11.0314
11.2487 11.3437
k =-0.0625 0.0884 0.8662 ( 7322 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6515 -6.6498 -6.2231 -6.2200 -6.1227 -6.1151
-6.0646 -6.0614 -1.1744 -1.1112 -1.0647 -1.0409 -0.9369 -0.8663
-0.8338 -0.8144 -0.4994 -0.3877 0.4346 0.5101 0.5697 0.5987
0.6421 0.6993 0.7935 0.8383 0.8545 0.9004 0.9559 0.9915
1.2904 1.3435 1.5654 1.5966 3.0440 3.0551 3.4611 3.4880
3.6874 3.7053 4.6962 4.7669 5.0120 5.1213 5.4565 5.5053
5.5294 5.5535 5.8320 5.9299 5.9752 6.0306 7.6012 7.6317
8.3479 8.3603 8.9772 9.0302 10.8490 10.9050 10.9939 11.0247
11.2575 11.3765
k =-0.0750 0.1060 0.8662 ( 7320 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6519 -6.6500 -6.2285 -6.2253 -6.1204 -6.1120
-6.0636 -6.0601 -1.1838 -1.1080 -1.0697 -1.0410 -0.9476 -0.8709
-0.8362 -0.8097 -0.4961 -0.3671 0.4292 0.5162 0.5666 0.5990
0.6368 0.6970 0.8047 0.8452 0.8585 0.9029 0.9564 1.0022
1.3029 1.3632 1.5717 1.6078 3.0506 3.0643 3.4591 3.4906
3.6900 3.7112 4.6595 4.7343 5.0007 5.1206 5.4243 5.4855
5.5002 5.5124 5.8211 5.9242 5.9650 6.0275 7.6297 7.6645
8.3814 8.3955 8.9876 9.0514 10.8245 10.8914 10.9810 11.0126
11.2728 11.4140
k =-0.0875 0.1237 0.8662 ( 7316 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6526 -6.6504 -6.2349 -6.2316 -6.1174 -6.1084
-6.0623 -6.0585 -1.1937 -1.1063 -1.0748 -1.0415 -0.9569 -0.8759
-0.8392 -0.8058 -0.4910 -0.3464 0.4244 0.5211 0.5639 0.5983
0.6334 0.6960 0.8144 0.8453 0.8699 0.9036 0.9585 1.0155
1.3188 1.3846 1.5800 1.6204 3.0585 3.0749 3.4572 3.4929
3.6933 3.7178 4.6202 4.6964 4.9897 5.1169 5.3781 5.4510
5.4645 5.4972 5.8085 5.9153 5.9525 6.0215 7.6636 7.7022
8.4189 8.4344 8.9974 9.0719 10.7917 10.8635 10.9680 10.9926
11.2961 11.4553
k =-0.0999 0.1414 0.8662 ( 7324 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.6534 -6.6510 -6.2423 -6.2391 -6.1134 -6.1042
-6.0607 -6.0566 -1.2041 -1.1072 -1.0788 -1.0421 -0.9646 -0.8806
-0.8426 -0.8028 -0.4846 -0.3261 0.4204 0.5246 0.5616 0.5970
0.6318 0.6967 0.8218 0.8447 0.8818 0.9034 0.9628 1.0310
1.3377 1.4077 1.5907 1.6344 3.0674 3.0869 3.4555 3.4947
3.6973 3.7248 4.5788 4.6547 4.9782 5.1102 5.3241 5.3991
5.4446 5.4858 5.7938 5.9038 5.9372 6.0127 7.7026 7.7444
8.4597 8.4760 9.0056 9.0902 10.7509 10.8231 10.9469 10.9661
11.3283 11.4956
k =-0.1124 0.1591 0.8662 ( 7320 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.6544 -6.6518 -6.2507 -6.2475 -6.1087 -6.0992
-6.0587 -6.0544 -1.2149 -1.1122 -1.0803 -1.0427 -0.9706 -0.8851
-0.8463 -0.8007 -0.4774 -0.3065 0.4170 0.5267 0.5595 0.5956
0.6313 0.6991 0.8262 0.8453 0.8892 0.9054 0.9700 1.0481
1.3596 1.4323 1.6037 1.6497 3.0771 3.1004 3.4539 3.4960
3.7017 3.7322 4.5363 4.6105 4.9659 5.0999 5.2678 5.3458
5.4266 5.4740 5.7771 5.8903 5.9194 6.0014 7.7463 7.7905
8.5028 8.5195 9.0111 9.1050 10.7026 10.7728 10.9088 10.9370
11.3692 11.5075
k =-0.1249 0.1767 0.8662 ( 7320 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.6557 -6.6529 -6.2600 -6.2569 -6.1032 -6.0936
-6.0563 -6.0519 -1.2259 -1.1209 -1.0794 -1.0430 -0.9752 -0.8890
-0.8503 -0.7992 -0.4698 -0.2881 0.4142 0.5277 0.5577 0.5945
0.6317 0.7032 0.8278 0.8472 0.8892 0.9115 0.9805 1.0662
1.3845 1.4584 1.6191 1.6664 3.0876 3.1151 3.4526 3.4966
3.7066 3.7397 4.4936 4.5650 4.9526 5.0849 5.2132 5.2929
5.4093 5.4615 5.7585 5.8750 5.8992 5.9880 7.7940 7.8403
8.5474 8.5639 9.0131 9.1151 10.6476 10.7147 10.8574 10.8998
11.4176 11.5014
k =-0.1249 0.1767 0.8662 ( 7320 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.6557 -6.6529 -6.2600 -6.2569 -6.1032 -6.0936
-6.0563 -6.0519 -1.2259 -1.1209 -1.0794 -1.0430 -0.9752 -0.8890
-0.8503 -0.7992 -0.4698 -0.2881 0.4142 0.5277 0.5577 0.5945
0.6317 0.7032 0.8278 0.8472 0.8892 0.9115 0.9805 1.0662
1.3845 1.4584 1.6191 1.6664 3.0876 3.1151 3.4526 3.4966
3.7066 3.7397 4.4936 4.5650 4.9526 5.0849 5.2132 5.2929
5.4093 5.4615 5.7585 5.8750 5.8992 5.9880 7.7940 7.8403
8.5474 8.5639 9.0131 9.1151 10.6476 10.7147 10.8574 10.8998
11.4176 11.5014
k =-0.1339 0.1894 0.8507 ( 7325 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7160
-14.7093 -14.7093 -6.6572 -6.6546 -6.2653 -6.2622 -6.1053 -6.0958
-6.0493 -6.0444 -1.2347 -1.1272 -1.0785 -1.0440 -0.9775 -0.8894
-0.8540 -0.8008 -0.4657 -0.2717 0.4115 0.5285 0.5592 0.5921
0.6349 0.7038 0.8258 0.8468 0.8892 0.9177 0.9916 1.0830
1.4089 1.4793 1.6233 1.6698 3.1006 3.1278 3.4601 3.5099
3.7038 3.7301 4.4640 4.5359 4.9308 5.0613 5.1857 5.2624
5.3957 5.4644 5.7347 5.8600 5.8671 5.9886 7.8327 7.8792
8.5794 8.5933 9.0149 9.1205 10.5892 10.6498 10.8312 10.8846
11.4465 11.4959
k =-0.1428 0.2020 0.8352 ( 7325 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7160
-14.7093 -14.7093 -6.6595 -6.6572 -6.2707 -6.2677 -6.1071 -6.0977
-6.0415 -6.0360 -1.2435 -1.1344 -1.0774 -1.0448 -0.9793 -0.8892
-0.8579 -0.8023 -0.4613 -0.2566 0.4085 0.5294 0.5622 0.5882
0.6386 0.7049 0.8238 0.8452 0.8894 0.9232 1.0042 1.1008
1.4351 1.5016 1.6301 1.6736 3.1162 3.1433 3.4586 3.5149
3.7072 3.7317 4.4327 4.5049 4.9040 5.0286 5.1641 5.2319
5.3776 5.4643 5.7145 5.8239 5.8514 5.9850 7.8777 7.9254
8.6150 8.6259 9.0149 9.1235 10.5229 10.5793 10.8073 10.8688
11.4782 11.4853
k =-0.1517 0.2146 0.8198 ( 7323 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7160
-14.7093 -14.7093 -6.6626 -6.6605 -6.2764 -6.2733 -6.1089 -6.0995
-6.0328 -6.0268 -1.2523 -1.1424 -1.0763 -1.0454 -0.9807 -0.8882
-0.8618 -0.8040 -0.4568 -0.2430 0.4055 0.5305 0.5665 0.5837
0.6421 0.7065 0.8223 0.8429 0.8897 0.9279 1.0176 1.1189
1.4630 1.5252 1.6399 1.6786 3.1340 3.1611 3.4498 3.5118
3.7144 3.7434 4.4004 4.4724 4.8731 4.9899 5.1459 5.2024
5.3550 5.4607 5.6985 5.7879 5.8327 5.9774 7.9283 7.9780
8.6528 8.6607 9.0137 9.1249 10.4503 10.5043 10.7858 10.8528
11.4720 11.5105
k =-0.1607 0.2273 0.8043 ( 7320 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7160
-14.7093 -14.7093 -6.6663 -6.6644 -6.2822 -6.2791 -6.1105 -6.1012
-6.0235 -6.0170 -1.2609 -1.1509 -1.0753 -1.0457 -0.9820 -0.8868
-0.8655 -0.8056 -0.4522 -0.2309 0.4024 0.5319 0.5719 0.5786
0.6452 0.7086 0.8210 0.8402 0.8899 0.9319 1.0306 1.1371
1.4927 1.5500 1.6528 1.6855 3.1532 3.1808 3.4365 3.5027
3.7246 3.7603 4.3677 4.4389 4.8397 4.9484 5.1281 5.1738
5.3290 5.4529 5.6865 5.7541 5.8110 5.9663 7.9836 8.0361
8.6895 8.6981 9.0122 9.1256 10.3734 10.4260 10.7665 10.8370
11.4574 11.5364
k =-0.1696 0.2399 0.7888 ( 7322 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7160
-14.7093 -14.7093 -6.6704 -6.6688 -6.2882 -6.2848 -6.1120 -6.1028
-6.0137 -6.0067 -1.2693 -1.1597 -1.0743 -1.0457 -0.9831 -0.8856
-0.8684 -0.8074 -0.4476 -0.2204 0.3995 0.5333 0.5734 0.5781
0.6479 0.7110 0.8200 0.8376 0.8898 0.9355 1.0424 1.1549
1.5241 1.5758 1.6685 1.6955 3.1733 3.2015 3.4211 3.4897
3.7360 3.7779 4.3355 4.4048 4.8052 4.9060 5.1092 5.1454
5.3014 5.4405 5.6775 5.7233 5.7875 5.9526 8.0426 8.0986
8.7220 8.7375 9.0119 9.1274 10.2938 10.3457 10.7493 10.8217
11.4416 11.5454
k =-0.1785 0.2525 0.7734 ( 7326 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7619 -14.7617 -14.7161 -14.7160
-14.7093 -14.7093 -6.6748 -6.6734 -6.2941 -6.2906 -6.1134 -6.1042
-6.0036 -5.9961 -1.2774 -1.1688 -1.0734 -1.0455 -0.9841 -0.8859
-0.8693 -0.8091 -0.4429 -0.2116 0.3967 0.5349 0.5680 0.5850
0.6502 0.7137 0.8188 0.8356 0.8896 0.9387 1.0523 1.1718
1.5572 1.6024 1.6855 1.7106 3.1934 3.2224 3.4054 3.4743
3.7467 3.7937 4.3044 4.3707 4.7714 4.8646 5.0888 5.1165
5.2731 5.4231 5.6709 5.6961 5.7638 5.9370 8.1045 8.1646
8.7491 8.7753 9.0145 9.1323 10.2130 10.2645 10.7342 10.8070
11.4245 11.5353
k =-0.1874 0.2652 0.7579 ( 7329 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7619 -14.7617 -14.7161 -14.7160
-14.7093 -14.7093 -6.6795 -6.6782 -6.3000 -6.2964 -6.1146 -6.1056
-5.9933 -5.9854 -1.2851 -1.1778 -1.0725 -1.0450 -0.9851 -0.8883
-0.8675 -0.8110 -0.4383 -0.2045 0.3942 0.5364 0.5626 0.5924
0.6521 0.7167 0.8171 0.8344 0.8892 0.9418 1.0600 1.1873
1.5920 1.6298 1.7026 1.7325 3.2125 3.2424 3.3910 3.4575
3.7552 3.8058 4.2753 4.3370 4.7398 4.8254 5.0671 5.0867
5.2448 5.4005 5.6649 5.6735 5.7413 5.9203 8.1683 8.2332
8.7692 8.8075 9.0230 9.1426 10.1327 10.1834 10.7210 10.7933
11.4064 11.5160
k =-0.1964 0.2778 0.7424 ( 7323 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7619 -14.7617 -14.7161 -14.7160
-14.7093 -14.7093 -6.6843 -6.6831 -6.3058 -6.3021 -6.1158 -6.1068
-5.9831 -5.9747 -1.2923 -1.1868 -1.0717 -1.0442 -0.9860 -0.8922
-0.8638 -0.8129 -0.4337 -0.1989 0.3920 0.5376 0.5575 0.5999
0.6539 0.7200 0.8148 0.8340 0.8886 0.9447 1.0654 1.2008
1.6282 1.6578 1.7206 1.7605 3.2291 3.2602 3.3793 3.4399
3.7607 3.8135 4.2484 4.3041 4.7116 4.7898 5.0445 5.0560
5.2163 5.3729 5.6501 5.6644 5.7213 5.9034 8.2330 8.3033
8.7810 8.8300 9.0403 9.1599 10.0541 10.1037 10.7094 10.7804
11.3872 11.4940
k =-0.2053 0.2904 0.7269 ( 7321 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7093 -14.7093 -6.6891 -6.6879 -6.3115 -6.3076 -6.1169 -6.1080
-5.9730 -5.9643 -1.2989 -1.1956 -1.0709 -1.0433 -0.9867 -0.8968
-0.8591 -0.8148 -0.4292 -0.1950 0.3902 0.5379 0.5531 0.6075
0.6558 0.7235 0.8122 0.8343 0.8880 0.9476 1.0689 1.2119
1.6649 1.6863 1.7411 1.7931 3.2411 3.2749 3.3717 3.4215
3.7628 3.8163 4.2241 4.2726 4.6877 4.7588 5.0194 5.0270
5.1871 5.3408 5.6333 5.6615 5.7048 5.8871 8.2977 8.3740
8.7848 8.8401 9.0680 9.1847 9.9784 10.0261 10.6993 10.7684
11.3671 11.4716
k =-0.2142 0.3031 0.7115 ( 7313 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.6938 -6.6926 -6.3170 -6.3130 -6.1178 -6.1090
-5.9632 -5.9542 -1.3050 -1.2042 -1.0702 -1.0422 -0.9874 -0.9018
-0.8537 -0.8168 -0.4247 -0.1925 0.3887 0.5365 0.5502 0.6146
0.6580 0.7272 0.8093 0.8349 0.8874 0.9504 1.0708 1.2204
1.7000 1.7161 1.7654 1.8293 3.2456 3.2867 3.3683 3.4033
3.7621 3.8148 4.2023 4.2432 4.6684 4.7333 4.9889 5.0035
5.1568 5.3051 5.6190 5.6595 5.6922 5.8719 8.3615 8.4444
8.7819 8.8388 9.1043 9.2159 9.9066 9.9517 10.6904 10.7571
11.3461 11.4500
k =-0.2232 0.3157 0.6960 ( 7311 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.6984 -6.6971 -6.3222 -6.3181 -6.1185 -6.1098
-5.9539 -5.9445 -1.3105 -1.2124 -1.0694 -1.0410 -0.9878 -0.9070
-0.8479 -0.8189 -0.4202 -0.1914 0.3877 0.5331 0.5490 0.6210
0.6611 0.7312 0.8065 0.8354 0.8868 0.9531 1.0716 1.2261
1.7309 1.7475 1.7951 1.8682 3.2414 3.2963 3.3632 3.3895
3.7590 3.8097 4.1830 4.2171 4.6534 4.7134 4.9572 4.9824
5.1251 5.2668 5.6071 5.6580 5.6836 5.8585 8.4233 8.5135
8.7741 8.8293 9.1460 9.2515 9.8396 9.8812 10.6825 10.7464
11.3244 11.4299
k =-0.2321 0.3283 0.6805 ( 7309 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.7027 -6.7013 -6.3271 -6.3229 -6.1192 -6.1106
-5.9451 -5.9355 -1.3154 -1.2202 -1.0687 -1.0398 -0.9881 -0.9123
-0.8419 -0.8210 -0.4158 -0.1916 0.3871 0.5285 0.5487 0.6263
0.6652 0.7352 0.8039 0.8356 0.8864 0.9556 1.0718 1.2292
1.7581 1.7782 1.8309 1.9089 3.2304 3.3030 3.3466 3.3872
3.7546 3.8022 4.1661 4.1959 4.6419 4.6985 4.9263 4.9627
5.0923 5.2276 5.5972 5.6564 5.6791 5.8472 8.4823 8.5803
8.7632 8.8145 9.1899 9.2895 9.7783 9.8157 10.6752 10.7359
11.3021 11.4114
k =-0.2410 0.3410 0.6651 ( 7305 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.7068 -6.7051 -6.3318 -6.3275 -6.1196 -6.1112
-5.9370 -5.9272 -1.3196 -1.2275 -1.0679 -1.0385 -0.9881 -0.9177
-0.8357 -0.8231 -0.4115 -0.1930 0.3869 0.5234 0.5486 0.6302
0.6706 0.7391 0.8017 0.8355 0.8861 0.9578 1.0718 1.2300
1.7830 1.8066 1.8717 1.9506 3.2148 3.3037 3.3258 3.3891
3.7494 3.7933 4.1517 4.1810 4.6328 4.6871 4.8974 4.9440
5.0591 5.1887 5.5888 5.6546 5.6784 5.8383 8.5373 8.6437
8.7507 8.7969 9.2340 9.3281 9.7231 9.7559 10.6680 10.7252
11.2792 11.3947
k =-0.2500 0.3536 0.6496 ( 7320 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.7105 -6.7086 -6.3360 -6.3316 -6.1199 -6.1116
-5.9297 -5.9197 -1.3231 -1.2343 -1.0671 -1.0373 -0.9878 -0.9232
-0.8300 -0.8249 -0.4072 -0.1955 0.3871 0.5181 0.5482 0.6329
0.6770 0.7428 0.8003 0.8350 0.8859 0.9596 1.0717 1.2287
1.8061 1.8330 1.9148 1.9922 3.1963 3.2867 3.3162 3.3897
3.7443 3.7842 4.1407 4.1731 4.6246 4.6770 4.8721 4.9265
5.0266 5.1515 5.5816 5.6524 5.6808 5.8320 8.5871 8.7006
8.7396 8.7789 9.2763 9.3658 9.6744 9.7027 10.6607 10.7142
11.2560 11.3799
k =-0.2589 0.3662 0.6341 ( 7302 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.7138 -6.7117 -6.3399 -6.3354 -6.1200 -6.1118
-5.9233 -5.9131 -1.3260 -1.2405 -1.0662 -1.0362 -0.9871 -0.9287
-0.8287 -0.8222 -0.4031 -0.1989 0.3877 0.5129 0.5475 0.6348
0.6842 0.7461 0.7997 0.8342 0.8857 0.9609 1.0717 1.2257
1.8275 1.8577 1.9581 2.0326 3.1763 3.2589 3.3124 3.3875
3.7394 3.7757 4.1343 4.1720 4.6157 4.6656 4.8521 4.9101
4.9962 5.1170 5.5754 5.6499 5.6858 5.8281 8.6299 8.7180
8.7570 8.7689 9.3155 9.4013 9.6323 9.6573 10.6529 10.7023
11.2328 11.3668
k =-0.2678 0.3788 0.6187 ( 7312 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7093 -6.7166 -6.7143 -6.3433 -6.3388 -6.1199 -6.1119
-5.9178 -5.9074 -1.3282 -1.2460 -1.0652 -1.0353 -0.9861 -0.9342
-0.8307 -0.8163 -0.3991 -0.2030 0.3887 0.5078 0.5462 0.6361
0.6916 0.7487 0.8003 0.8331 0.8855 0.9618 1.0720 1.2212
1.8471 1.8809 1.9998 2.0705 3.1560 3.2296 3.3070 3.3819
3.7350 3.7685 4.1334 4.1773 4.6045 4.6505 4.8386 4.8954
4.9696 5.0858 5.5701 5.6470 5.6927 5.8266 8.6621 8.7067
8.7510 8.8116 9.3502 9.4333 9.5968 9.6209 10.6442 10.6893
11.2102 11.3555
k =-0.2767 0.3915 0.6032 ( 7316 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7093 -6.7190 -6.7164 -6.3463 -6.3418 -6.1195 -6.1117
-5.9133 -5.9028 -1.3297 -1.2510 -1.0642 -1.0345 -0.9847 -0.9397
-0.8331 -0.8103 -0.3953 -0.2078 0.3900 0.5030 0.5446 0.6372
0.6986 0.7507 0.8021 0.8320 0.8851 0.9622 1.0724 1.2157
1.8648 1.9023 2.0381 2.1042 3.1366 3.2016 3.2995 3.3734
3.7311 3.7630 4.1382 4.1881 4.5899 4.6306 4.8316 4.8833
4.9481 5.0584 5.5657 5.6440 5.7008 5.8270 8.6782 8.6942
8.7534 8.8533 9.3794 9.4606 9.5681 9.5940 10.6344 10.6749
11.1890 11.3459
k =-0.2857 0.4041 0.5877 ( 7313 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7093 -6.7209 -6.7180 -6.3488 -6.3443 -6.1190 -6.1114
-5.9099 -5.8993 -1.3306 -1.2552 -1.0631 -1.0339 -0.9829 -0.9451
-0.8355 -0.8045 -0.3917 -0.2130 0.3917 0.4985 0.5424 0.6382
0.7048 0.7523 0.8050 0.8311 0.8847 0.9621 1.0728 1.2093
1.8803 1.9218 2.0711 2.1324 3.1194 3.1772 3.2905 3.3624
3.7277 3.7591 4.1486 4.2036 4.5717 4.6067 4.8289 4.8749
4.9332 5.0347 5.5622 5.6410 5.7093 5.8290 8.6804 8.6821
8.7666 8.8876 9.4023 9.4815 9.5480 9.5761 10.6233 10.6592
11.1703 11.3380
k =-0.2946 0.4167 0.5722 ( 7311 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7093 -6.7222 -6.7191 -6.3508 -6.3464 -6.1183 -6.1108
-5.9076 -5.8968 -1.3309 -1.2586 -1.0619 -1.0335 -0.9808 -0.9504
-0.8381 -0.7989 -0.3885 -0.2184 0.3936 0.4943 0.5399 0.6391
0.7095 0.7542 0.8085 0.8308 0.8841 0.9617 1.0730 1.2024
1.8934 1.9390 2.0969 2.1533 3.1057 3.1586 3.2811 3.3499
3.7244 3.7559 4.1640 4.2229 4.5509 4.5805 4.8268 4.8712
4.9259 5.0149 5.5597 5.6382 5.7175 5.8322 8.6714 8.6785
8.7810 8.9136 9.4192 9.4937 9.5392 9.5654 10.6109 10.6423
11.1552 11.3319
k =-0.3035 0.4294 0.5568 ( 7314 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7093 -6.7230 -6.7197 -6.3523 -6.3479 -6.1173 -6.1101
-5.9064 -5.8956 -1.3306 -1.2612 -1.0607 -1.0333 -0.9782 -0.9556
-0.8406 -0.7935 -0.3856 -0.2239 0.3957 0.4904 0.5371 0.6400
0.7121 0.7569 0.8116 0.8318 0.8834 0.9609 1.0727 1.1951
1.9040 1.9537 2.1138 2.1656 3.0961 3.1478 3.2726 3.3374
3.7208 3.7527 4.1840 4.2447 4.5292 4.5544 4.8213 4.8728
4.9268 4.9989 5.5585 5.6359 5.7249 5.8362 8.6631 8.6775
8.7910 8.9304 9.4307 9.4991 9.5403 9.5593 10.5974 10.6245
11.1444 11.3277
k =-0.3125 0.4420 0.5413 ( 7326 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7093 -6.7233 -6.7197 -6.3534 -6.3490 -6.1161 -6.1091
-5.9063 -5.8954 -1.3297 -1.2630 -1.0594 -1.0332 -0.9754 -0.9607
-0.8432 -0.7885 -0.3833 -0.2293 0.3980 0.4870 0.5342 0.6410
0.7124 0.7605 0.8136 0.8349 0.8825 0.9599 1.0718 1.1878
1.9119 1.9658 2.1203 2.1686 3.0907 3.1461 3.2662 3.3269
3.7160 3.7482 4.2079 4.2675 4.5081 4.5322 4.8116 4.8784
4.9346 4.9878 5.5585 5.6345 5.7311 5.8408 8.6579 8.6790
8.7950 8.9377 9.4377 9.5046 9.5440 9.5565 10.5833 10.6061
11.1387 11.3258
k =-0.3125 0.4420 0.5413 ( 7326 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7093 -6.7233 -6.7197 -6.3534 -6.3490 -6.1161 -6.1091
-5.9063 -5.8954 -1.3297 -1.2630 -1.0594 -1.0332 -0.9754 -0.9607
-0.8432 -0.7885 -0.3833 -0.2293 0.3980 0.4870 0.5342 0.6410
0.7124 0.7605 0.8136 0.8349 0.8825 0.9599 1.0718 1.1878
1.9119 1.9658 2.1203 2.1686 3.0907 3.1461 3.2662 3.3269
3.7160 3.7482 4.2079 4.2675 4.5081 4.5322 4.8116 4.8784
4.9346 4.9878 5.5585 5.6345 5.7311 5.8408 8.6579 8.6790
8.7950 8.9377 9.4377 9.5046 9.5440 9.5565 10.5833 10.6061
11.1387 11.3258
k =-0.3033 0.4290 0.5254 ( 7322 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7093 -6.7284 -6.7248 -6.3370 -6.3324 -6.1243 -6.1170
-5.9086 -5.8974 -1.3223 -1.2539 -1.0643 -1.0367 -0.9779 -0.9630
-0.8385 -0.7869 -0.3757 -0.2358 0.3969 0.4847 0.5318 0.6371
0.7094 0.7586 0.8112 0.8369 0.8921 0.9621 1.0778 1.1846
1.9149 1.9699 2.1029 2.1476 3.1012 3.1369 3.2538 3.3163
3.7096 3.7464 4.1593 4.2154 4.4987 4.5249 4.8272 4.8887
4.9473 5.0053 5.5657 5.6424 5.7391 5.8465 8.6745 8.6978
8.8189 8.9450 9.4802 9.5393 9.5829 9.5967 10.6594 10.6877
11.1859 11.3122
k =-0.2941 0.4160 0.5095 ( 7326 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.7356 -6.7321 -6.3201 -6.3154 -6.1302 -6.1227
-5.9108 -5.8995 -1.3148 -1.2446 -1.0687 -1.0403 -0.9804 -0.9649
-0.8337 -0.7856 -0.3693 -0.2444 0.3961 0.4822 0.5303 0.6325
0.7033 0.7596 0.8076 0.8406 0.9018 0.9642 1.0836 1.1804
1.9170 1.9728 2.0874 2.1274 3.1074 3.1253 3.2438 3.3133
3.7027 3.7443 4.1145 4.1663 4.4850 4.5132 4.8474 4.9075
4.9667 5.0261 5.5696 5.6464 5.7451 5.8491 8.6791 8.7154
8.8476 8.9555 9.5193 9.5753 9.6146 9.6397 10.7243 10.7607
11.1990 11.2934
k =-0.2849 0.4030 0.4935 ( 7306 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.7450 -6.7415 -6.3029 -6.2980 -6.1338 -6.1261
-5.9130 -5.9016 -1.3070 -1.2354 -1.0726 -1.0437 -0.9827 -0.9663
-0.8287 -0.7847 -0.3641 -0.2549 0.3954 0.4795 0.5300 0.6272
0.6947 0.7625 0.8037 0.8453 0.9111 0.9661 1.0889 1.1757
1.9182 1.9743 2.0738 2.1082 3.0972 3.1245 3.2354 3.3174
3.6942 3.7412 4.0749 4.1216 4.4687 4.4992 4.8708 4.9340
4.9913 5.0493 5.5707 5.6467 5.7488 5.8482 8.6791 8.7286
8.8765 8.9689 9.5553 9.6127 9.6469 9.6767 10.7736 10.8218
11.1944 11.2801
k =-0.2757 0.3900 0.4776 ( 7308 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.7564 -6.7530 -6.2853 -6.2802 -6.1352 -6.1272
-5.9152 -5.9037 -1.2992 -1.2264 -1.0760 -1.0471 -0.9851 -0.9670
-0.8237 -0.7842 -0.3605 -0.2667 0.3949 0.4768 0.5306 0.6213
0.6850 0.7664 0.7997 0.8510 0.9199 0.9679 1.0937 1.1707
1.9184 1.9742 2.0622 2.0900 3.0783 3.1275 3.2300 3.3267
3.6831 3.7361 4.0415 4.0823 4.4521 4.4852 4.8955 4.9667
5.0195 5.0747 5.5695 5.6439 5.7500 5.8436 8.6779 8.7368
8.9028 8.9837 9.5874 9.6519 9.6807 9.7068 10.8048 10.8680
11.1844 11.2746
k =-0.2665 0.3770 0.4617 ( 7308 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.7697 -6.7665 -6.2675 -6.2622 -6.1343 -6.1262
-5.9174 -5.9058 -1.2913 -1.2175 -1.0788 -1.0505 -0.9876 -0.9671
-0.8186 -0.7841 -0.3592 -0.2794 0.3945 0.4743 0.5321 0.6147
0.6747 0.7704 0.7961 0.8574 0.9281 0.9697 1.0975 1.1658
1.9174 1.9720 2.0528 2.0734 3.0583 3.1267 3.2292 3.3392
3.6682 3.7277 4.0148 4.0498 4.4378 4.4736 4.9193 5.0040
5.0489 5.1031 5.5667 5.6389 5.7485 5.8352 8.6770 8.7411
8.9246 8.9980 9.6139 9.6934 9.7170 9.7304 10.8183 10.8973
11.1728 11.2719
k =-0.2573 0.3640 0.4458 ( 7286 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.7849 -6.7818 -6.2494 -6.2440 -6.1314 -6.1232
-5.9195 -5.9080 -1.2834 -1.2089 -1.0812 -1.0537 -0.9901 -0.9664
-0.8136 -0.7843 -0.3610 -0.2916 0.3941 0.4722 0.5343 0.6074
0.6645 0.7742 0.7930 0.8644 0.9356 0.9714 1.1000 1.1616
1.9151 1.9672 2.0459 2.0587 3.0388 3.1216 3.2333 3.3538
3.6488 3.7148 3.9942 4.0247 4.4282 4.4667 4.9403 5.0430
5.0771 5.1366 5.5634 5.6324 5.7443 5.8230 8.6768 8.7425
8.9409 9.0103 9.6331 9.7350 9.7466 9.7611 10.8176 10.9105
11.1572 11.2622
k =-0.2481 0.3510 0.4299 ( 7286 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.8016 -6.7988 -6.2311 -6.2256 -6.1266 -6.1183
-5.9216 -5.9101 -1.2757 -1.2006 -1.0830 -1.0568 -0.9927 -0.9650
-0.8086 -0.7849 -0.3671 -0.3020 0.3938 0.4707 0.5371 0.5998
0.6546 0.7776 0.7903 0.8719 0.9421 0.9732 1.1007 1.1584
1.9114 1.9593 2.0414 2.0467 3.0202 3.1133 3.2412 3.3695
3.6252 3.6972 3.9784 4.0070 4.4257 4.4663 4.9568 5.0748
5.1083 5.1767 5.5606 5.6253 5.7382 5.8073 8.6774 8.7414
8.9511 9.0196 9.6446 9.7499 9.7902 9.8061 10.8071 10.9109
11.1328 11.2359
k =-0.2389 0.3380 0.4139 ( 7294 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.8197 -6.8170 -6.2127 -6.2071 -6.1201 -6.1118
-5.9235 -5.9122 -1.2681 -1.1929 -1.0844 -1.0598 -0.9955 -0.9627
-0.8038 -0.7859 -0.3784 -0.3097 0.3933 0.4699 0.5404 0.5919
0.6451 0.7805 0.7884 0.8797 0.9479 0.9749 1.0993 1.1566
1.9062 1.9481 2.0376 2.0395 3.0029 3.1031 3.2514 3.3859
3.5985 3.6756 3.9657 3.9949 4.4319 4.4741 4.9673 5.0891
5.1507 5.2225 5.5588 5.6176 5.7314 5.7891 8.6779 8.7377
8.9553 9.0258 9.6490 9.7524 9.8429 9.8555 10.7903 10.9022
11.0951 11.1877
k =-0.2298 0.3250 0.3980 ( 7288 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7094 -14.7093 -6.8389 -6.8364 -6.1943 -6.1886 -6.1122 -6.1039
-5.9254 -5.9142 -1.2607 -1.1857 -1.0852 -1.0627 -0.9982 -0.9595
-0.7992 -0.7871 -0.3940 -0.3150 0.3928 0.4698 0.5440 0.5842
0.6360 0.7824 0.7875 0.8876 0.9528 0.9768 1.0961 1.1561
1.8994 1.9342 2.0322 2.0389 2.9871 3.0919 3.2630 3.4024
3.5700 3.6514 3.9552 3.9860 4.4481 4.4910 4.9705 5.0903
5.1991 5.2723 5.5573 5.6089 5.7256 5.7707 8.6767 8.7307
8.9545 9.0298 9.6470 9.7486 9.8992 9.9082 10.7695 10.8876
11.0424 11.1187
k =-0.2206 0.3120 0.3821 ( 7288 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7094 -14.7093 -6.8589 -6.8566 -6.1759 -6.1702 -6.1030 -6.0948
-5.9271 -5.9161 -1.2536 -1.1792 -1.0855 -1.0655 -1.0010 -0.9555
-0.7954 -0.7883 -0.4128 -0.3189 0.3922 0.4704 0.5479 0.5769
0.6274 0.7830 0.7883 0.8952 0.9571 0.9786 1.0912 1.1566
1.8913 1.9180 2.0297 2.0400 2.9729 3.0801 3.2749 3.4184
3.5411 3.6268 3.9463 3.9788 4.4743 4.5172 4.9659 5.0814
5.2501 5.3247 5.5531 5.5981 5.7216 5.7575 8.6712 8.7192
8.9508 9.0332 9.6392 9.7392 9.9583 9.9632 10.7463 10.8684
10.9761 11.0341
k =-0.2114 0.2990 0.3662 ( 7288 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7094 -14.7093 -6.8795 -6.8774 -6.1577 -6.1519 -6.0929 -6.0848
-5.9287 -5.9179 -1.2468 -1.1734 -1.0855 -1.0682 -1.0037 -0.9506
-0.7938 -0.7877 -0.4334 -0.3224 0.3914 0.4716 0.5517 0.5705
0.6194 0.7827 0.7901 0.9023 0.9610 0.9803 1.0852 1.1574
1.8821 1.9005 2.0299 2.0422 2.9600 3.0680 3.2863 3.4324
3.5131 3.6042 3.9386 3.9727 4.5100 4.5524 4.9532 5.0639
5.3025 5.3786 5.5409 5.5840 5.7185 5.7579 8.6578 8.7014
8.9476 9.0381 9.6260 9.7248 10.0186 10.0203 10.7213 10.8422
10.9000 10.9427
k =-0.2022 0.2860 0.3503 ( 7294 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7094 -14.7093 -6.9005 -6.8986 -6.1397 -6.1339 -6.0819 -6.0741
-5.9300 -5.9196 -1.2404 -1.1684 -1.0851 -1.0707 -1.0063 -0.9448
-0.7953 -0.7847 -0.4550 -0.3261 0.3905 0.4732 0.5548 0.5657
0.6121 0.7823 0.7925 0.9085 0.9649 0.9817 1.0786 1.1584
1.8717 1.8822 2.0324 2.0456 2.9487 3.0555 3.2960 3.4424
3.4873 3.5862 3.9321 3.9683 4.5541 4.5959 4.9332 5.0392
5.3557 5.4325 5.5190 5.5629 5.7221 5.7729 8.6335 8.6750
8.9486 9.0461 9.6075 9.7054 10.0752 10.0824 10.6932 10.7908
10.8178 10.8700
k =-0.1930 0.2730 0.3343 ( 7312 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7094 -14.7093 -6.9217 -6.9199 -6.1220 -6.1163 -6.0704 -6.0628
-5.9310 -5.9211 -1.2343 -1.1643 -1.0846 -1.0730 -1.0087 -0.9383
-0.7979 -0.7814 -0.4770 -0.3301 0.3895 0.4750 0.5552 0.5648
0.6059 0.7818 0.7951 0.9135 0.9690 0.9827 1.0716 1.1592
1.8592 1.8650 2.0368 2.0502 2.9386 3.0428 3.3024 3.4444
3.4663 3.5760 3.9274 3.9662 4.6047 4.6468 4.9071 5.0088
5.4088 5.4723 5.5026 5.5325 5.7374 5.7976 8.5969 8.6380
8.9565 9.0586 9.5839 9.6811 10.1294 10.1453 10.6506 10.7088
10.7337 10.8375
k =-0.1838 0.2600 0.3184 ( 7312 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7094 -14.7093 -6.9428 -6.9412 -6.1049 -6.0993 -6.0583 -6.0510
-5.9318 -5.9223 -1.2287 -1.1609 -1.0843 -1.0749 -1.0108 -0.9311
-0.8009 -0.7784 -0.4989 -0.3347 0.3883 0.4766 0.5530 0.5679
0.6009 0.7813 0.7982 0.9174 0.9734 0.9831 1.0645 1.1595
1.8418 1.8520 2.0428 2.0560 2.9297 3.0298 3.3039 3.4318
3.4568 3.5747 3.9251 3.9674 4.6598 4.7041 4.8770 4.9743
5.4441 5.4585 5.4959 5.5490 5.7628 5.8291 8.5486 8.5894
8.9719 9.0757 9.5554 9.6518 10.1786 10.2080 10.5685 10.6172
10.6867 10.8187
k =-0.1746 0.2470 0.3025 ( 7292 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7094 -14.7093 -6.9638 -6.9623 -6.0884 -6.0831 -6.0458 -6.0390
-5.9321 -5.9232 -1.2235 -1.1584 -1.0846 -1.0759 -1.0126 -0.9233
-0.8043 -0.7759 -0.5201 -0.3399 0.3870 0.4775 0.5509 0.5722
0.5976 0.7807 0.8016 0.9201 0.9780 0.9829 1.0575 1.1594
1.8230 1.8403 2.0502 2.0635 2.9218 3.0167 3.2994 3.4118
3.4540 3.5799 3.9258 3.9727 4.7143 4.7669 4.8478 4.9378
5.4031 5.4420 5.5204 5.6023 5.7955 5.8651 8.4898 8.5299
8.9938 9.0973 9.5223 9.6177 10.2166 10.2692 10.4659 10.5280
10.6647 10.8052
k =-0.1654 0.2340 0.2866 ( 7298 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7094 -14.7093 -6.9844 -6.9831 -6.0729 -6.0678 -6.0330 -6.0269
-5.9319 -5.9237 -1.2187 -1.1566 -1.0859 -1.0761 -1.0139 -0.9151
-0.8079 -0.7740 -0.5403 -0.3457 0.3855 0.4773 0.5498 0.5771
0.5962 0.7799 0.8055 0.9217 0.9821 0.9826 1.0508 1.1587
1.8042 1.8286 2.0587 2.0728 2.9149 3.0035 3.2893 3.3905
3.4542 3.5876 3.9304 3.9823 4.7480 4.8303 4.8410 4.9031
5.3586 5.3940 5.5720 5.6551 5.8334 5.9044 8.4219 8.4607
9.0203 9.1222 9.4851 9.5790 10.2261 10.3273 10.3618 10.4601
10.6518 10.7959
k =-0.1562 0.2210 0.2707 ( 7294 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7094 -14.7094 -7.0045 -7.0033 -6.0584 -6.0538 -6.0199 -6.0145
-5.9311 -5.9237 -1.2143 -1.1556 -1.0879 -1.0757 -1.0148 -0.9066
-0.8117 -0.7728 -0.5591 -0.3521 0.3840 0.4757 0.5498 0.5827
0.5969 0.7790 0.8098 0.9224 0.9806 0.9869 1.0445 1.1574
1.7858 1.8168 2.0683 2.0842 2.9088 2.9904 3.2752 3.3687
3.4563 3.5945 3.9396 3.9966 4.7340 4.8406 4.8997 4.9079
5.3132 5.3431 5.6238 5.7065 5.8749 5.9458 8.3461 8.3834
9.0496 9.1493 9.4447 9.5366 10.1824 10.2598 10.3820 10.4386
10.6454 10.7908
k =-0.1470 0.2080 0.2547 ( 7302 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7094 -14.7094 -7.0241 -7.0230 -6.0454 -6.0411 -6.0066 -6.0021
-5.9296 -5.9231 -1.2103 -1.1551 -1.0902 -1.0752 -1.0150 -0.8982
-0.8157 -0.7725 -0.5760 -0.3591 0.3824 0.4726 0.5506 0.5887
0.5999 0.7780 0.8145 0.9225 0.9785 0.9905 1.0387 1.1554
1.7681 1.8050 2.0792 2.0975 2.9034 2.9776 3.2592 3.3470
3.4587 3.5983 3.9537 4.0155 4.7011 4.8103 4.9514 4.9814
5.2694 5.2927 5.6747 5.7560 5.9190 5.9883 8.2637 8.2992
9.0793 9.1763 9.4034 9.4921 10.0990 10.1606 10.4276 10.4549
10.6456 10.7896
k =-0.1379 0.1950 0.2388 ( 7308 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7094 -14.7094 -7.0429 -7.0419 -6.0341 -6.0301 -5.9933 -5.9895
-5.9273 -5.9218 -1.2067 -1.1552 -1.0926 -1.0750 -1.0146 -0.8901
-0.8199 -0.7732 -0.5906 -0.3666 0.3807 0.4683 0.5522 0.5942
0.6061 0.7768 0.8196 0.9222 0.9759 0.9932 1.0336 1.1527
1.7513 1.7931 2.0915 2.1127 2.8988 2.9654 3.2424 3.3258
3.4596 3.5978 3.9729 4.0386 4.6659 4.7750 5.0031 5.0557
5.2290 5.2530 5.7243 5.8032 5.9647 6.0314 8.1757 8.2093
9.1059 9.1983 9.3662 9.4484 10.0037 10.0625 10.4606 10.4855
10.6533 10.7922
k =-0.1287 0.1820 0.2229 ( 7304 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7094 -14.7094 -7.0609 -7.0600 -6.0246 -6.0207 -5.9801 -5.9770
-5.9241 -5.9196 -1.2035 -1.1558 -1.0950 -1.0751 -1.0136 -0.8826
-0.8240 -0.7749 -0.6024 -0.3746 0.3792 0.4629 0.5545 0.5984
0.6157 0.7756 0.8250 0.9215 0.9729 0.9947 1.0292 1.1491
1.7355 1.7812 2.1054 2.1297 2.8949 2.9541 3.2258 3.3053
3.4577 3.5920 3.9966 4.0658 4.6323 4.7413 5.0284 5.1134
5.2022 5.2497 5.7723 5.8481 6.0112 6.0742 8.0830 8.1147
9.1234 9.2043 9.3446 9.4111 9.9077 9.9661 10.4841 10.5148
10.6689 10.7977
k =-0.1195 0.1690 0.2070 ( 7316 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7094 -14.7094 -7.0779 -7.0771 -6.0168 -6.0129 -5.9672 -5.9646
-5.9201 -5.9166 -1.2006 -1.1567 -1.0972 -1.0757 -1.0119 -0.8764
-0.8278 -0.7776 -0.6112 -0.3831 0.3777 0.4568 0.5572 0.6020
0.6278 0.7743 0.8307 0.9207 0.9698 0.9948 1.0257 1.1446
1.7209 1.7693 2.1210 2.1482 2.8916 2.9440 3.2099 3.2856
3.4519 3.5806 4.0241 4.0963 4.6021 4.7107 5.0147 5.0981
5.2480 5.2916 5.8185 5.8904 6.0578 6.1164 7.9866 8.0163
9.1225 9.1848 9.3486 9.3896 9.8148 9.8726 10.5012 10.5363
10.6909 10.8051
k =-0.1103 0.1560 0.1910 ( 7312 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7094 -14.7094 -7.0940 -7.0933 -6.0107 -6.0067 -5.9547 -5.9525
-5.9153 -5.9128 -1.1980 -1.1580 -1.0993 -1.0767 -1.0096 -0.8720
-0.8309 -0.7812 -0.6168 -0.3920 0.3765 0.4503 0.5604 0.6051
0.6415 0.7730 0.8368 0.9198 0.9667 0.9937 1.0227 1.1390
1.7075 1.7576 2.1383 2.1681 2.8890 2.9355 3.1952 3.2667
3.4417 3.5636 4.0545 4.1297 4.5764 4.6839 4.9781 5.0513
5.3275 5.3602 5.8628 5.9302 6.1037 6.1575 7.8870 7.9147
9.0973 9.1480 9.3682 9.3924 9.7264 9.7830 10.5125 10.5505
10.7158 10.8134
k =-0.1011 0.1430 0.1751 ( 7306 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7094 -14.7094 -7.1091 -7.1084 -6.0060 -6.0019 -5.9429 -5.9411
-5.9100 -5.9082 -1.1958 -1.1596 -1.1012 -1.0781 -1.0067 -0.8703
-0.8327 -0.7855 -0.6192 -0.4014 0.3754 0.4436 0.5640 0.6080
0.6563 0.7717 0.8431 0.9189 0.9637 0.9916 1.0201 1.1323
1.6955 1.7461 2.1572 2.1892 2.8872 2.9291 3.1818 3.2487
3.4268 3.5412 4.0869 4.1652 4.5557 4.6612 4.9332 5.0013
5.4131 5.4404 5.9050 5.9675 6.1483 6.1969 7.7850 7.8106
9.0547 9.1017 9.3930 9.4157 9.6436 9.6981 10.5192 10.5592
10.7400 10.8213
k =-0.0919 0.1300 0.1592 ( 7290 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7095 -14.7094 -7.1230 -7.1224 -6.0025 -5.9984 -5.9318 -5.9303
-5.9043 -5.9029 -1.1938 -1.1613 -1.1029 -1.0800 -1.0032 -0.8717
-0.8327 -0.7900 -0.6187 -0.4111 0.3745 0.4369 0.5679 0.6105
0.6717 0.7705 0.8498 0.9183 0.9611 0.9888 1.0176 1.1244
1.6849 1.7349 2.1776 2.2110 2.8860 2.9253 3.1697 3.2315
3.4073 3.5139 4.1204 4.2022 4.5402 4.6425 4.8861 4.9520
5.5008 5.5261 5.9451 6.0023 6.1911 6.2343 7.6812 7.7048
9.0050 9.0498 9.4225 9.4465 9.5671 9.6189 10.5223 10.5639
10.7612 10.8280
k =-0.0827 0.1170 0.1433 ( 7286 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7546 -14.7617 -14.7616 -14.7161 -14.7161
-14.7095 -14.7094 -7.1357 -7.1352 -5.9998 -5.9959 -5.9216 -5.9205
-5.8985 -5.8973 -1.1920 -1.1631 -1.1043 -1.0822 -0.9992 -0.8759
-0.8315 -0.7945 -0.6155 -0.4213 0.3740 0.4302 0.5721 0.6125
0.6871 0.7694 0.8568 0.9181 0.9588 0.9857 1.0150 1.1152
1.6757 1.7241 2.1990 2.2331 2.8856 2.9244 3.1590 3.2149
3.3837 3.4822 4.1543 4.2401 4.5296 4.6276 4.8395 4.9045
5.5894 5.6145 5.9834 6.0349 6.2316 6.2694 7.5761 7.5977
8.9536 8.9959 9.4541 9.4756 9.4999 9.5471 10.5228 10.5652
10.7783 10.8332
k =-0.0735 0.1040 0.1274 ( 7284 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7546 -14.7617 -14.7616 -14.7161 -14.7161
-14.7095 -14.7094 -7.1473 -7.1468 -5.9979 -5.9941 -5.9124 -5.9116
-5.8927 -5.8915 -1.1905 -1.1650 -1.1055 -1.0846 -0.9948 -0.8820
-0.8296 -0.7987 -0.6101 -0.4318 0.3737 0.4238 0.5764 0.6141
0.7020 0.7683 0.8645 0.9183 0.9570 0.9825 1.0119 1.1046
1.6681 1.7137 2.2213 2.2551 2.8862 2.9269 3.1496 3.1990
3.3569 3.4468 4.1880 4.2779 4.5235 4.6158 4.7949 4.8595
5.6777 5.7039 6.0203 6.0657 6.2693 6.3019 7.4702 7.4899
8.9033 8.9424 9.4314 9.4686 9.4940 9.5179 10.5214 10.5638
10.7915 10.8366
k =-0.0643 0.0910 0.1114 ( 7272 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7617 -14.7616 -14.7161 -14.7161
-14.7095 -14.7094 -7.1575 -7.1571 -5.9965 -5.9930 -5.9043 -5.9038
-5.8870 -5.8858 -1.1891 -1.1670 -1.1064 -1.0871 -0.9899 -0.8893
-0.8277 -0.8025 -0.6029 -0.4427 0.3738 0.4177 0.5807 0.6152
0.7160 0.7675 0.8729 0.9193 0.9557 0.9794 1.0085 1.0928
1.6619 1.7038 2.2437 2.2763 2.8884 2.9328 3.1408 3.1836
3.3282 3.4087 4.2207 4.3151 4.5208 4.6066 4.7536 4.8171
5.7638 5.7924 6.0566 6.0957 6.3041 6.3314 7.3641 7.3818
8.8560 8.8913 9.3763 9.4135 9.5234 9.5451 10.5189 10.5601
10.8010 10.8383
k =-0.0551 0.0780 0.0955 ( 7282 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7617 -14.7616 -14.7161 -14.7161
-14.7095 -14.7094 -7.1665 -7.1662 -5.9954 -5.9923 -5.8974 -5.8971
-5.8817 -5.8804 -1.1879 -1.1689 -1.1069 -1.0898 -0.9847 -0.8972
-0.8260 -0.8058 -0.5942 -0.4538 0.3743 0.4118 0.5851 0.6158
0.7284 0.7668 0.8822 0.9209 0.9548 0.9767 1.0048 1.0798
1.6571 1.6946 2.2659 2.2962 2.8927 2.9421 3.1318 3.1692
3.2991 3.3690 4.2522 4.3506 4.5206 4.5993 4.7167 4.7776
5.8453 5.8772 6.0943 6.1274 6.3357 6.3579 7.2583 7.2742
8.8129 8.8440 9.3280 9.3608 9.5534 9.5722 10.5159 10.5547
10.8079 10.8387
k =-0.0460 0.0650 0.0796 ( 7274 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1741 -7.1738 -5.9946 -5.9919 -5.8917 -5.8913
-5.8768 -5.8755 -1.1867 -1.1708 -1.1072 -1.0924 -0.9790 -0.9054
-0.8245 -0.8087 -0.5843 -0.4653 0.3751 0.4064 0.5895 0.6159
0.7389 0.7662 0.8925 0.9232 0.9544 0.9747 1.0007 1.0656
1.6538 1.6861 2.2869 2.3141 2.8997 2.9546 3.1206 3.1569
3.2715 3.3286 4.2822 4.3832 4.5217 4.5937 4.6853 4.7409
5.9179 5.9528 6.1366 6.1648 6.3643 6.3814 7.1536 7.1675
8.7751 8.8016 9.2873 9.3150 9.5807 9.5964 10.5131 10.5480
10.8128 10.8380
k =-0.0368 0.0520 0.0637 ( 7274 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1804 -7.1802 -5.9940 -5.9918 -5.8871 -5.8867
-5.8725 -5.8714 -1.1855 -1.1728 -1.1071 -1.0949 -0.9730 -0.9138
-0.8231 -0.8112 -0.5736 -0.4771 0.3763 0.4013 0.5937 0.6153
0.7473 0.7657 0.9035 0.9261 0.9547 0.9734 0.9964 1.0505
1.6518 1.6783 2.3062 2.3292 2.9097 2.9695 3.1057 3.1477
3.2472 3.2892 4.3105 4.4104 4.5237 4.5901 4.6600 4.7068
5.9767 6.0113 6.1886 6.2127 6.3902 6.4023 7.0508 7.0628
8.7435 8.7651 9.2544 9.2767 9.6043 9.6167 10.5109 10.5407
10.8164 10.8365
k =-0.0276 0.0390 0.0478 ( 7270 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1853 -7.1851 -5.9935 -5.9918 -5.8836 -5.8832
-5.8689 -5.8680 -1.1842 -1.1746 -1.1066 -1.0974 -0.9667 -0.9220
-0.8219 -0.8133 -0.5622 -0.4890 0.3779 0.3966 0.5977 0.6143
0.7535 0.7653 0.9142 0.9293 0.9563 0.9733 0.9920 1.0346
1.6511 1.6714 2.3230 2.3409 2.9229 2.9852 3.0888 3.1403
3.2272 3.2530 4.3371 4.4281 4.5288 4.5893 4.6410 4.6752
6.0194 6.0482 6.2505 6.2701 6.4154 6.4224 6.9518 6.9617
8.7188 8.7352 9.2293 9.2461 9.6236 9.6328 10.5097 10.5333
10.8193 10.8343
k =-0.0184 0.0260 0.0318 ( 7257 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1888 -7.1887 -5.9930 -5.9919 -5.8810 -5.8807
-5.8662 -5.8656 -1.1829 -1.1765 -1.1058 -1.0996 -0.9600 -0.9301
-0.8208 -0.8152 -0.5503 -0.5012 0.3799 0.3924 0.6014 0.6127
0.7580 0.7649 0.9229 0.9321 0.9610 0.9742 0.9878 1.0184
1.6517 1.6654 2.3365 2.3488 2.9392 2.9962 3.0768 3.1313
3.2122 3.2234 4.3620 4.4316 4.5413 4.5912 4.6270 4.6459
6.0479 6.0678 6.3111 6.3257 6.4439 6.4469 6.8600 6.8678
8.7015 8.7126 9.2122 9.2234 9.6381 9.6442 10.5099 10.5262
10.8218 10.8319
k =-0.0092 0.0130 0.0159 ( 7233 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1909 -7.1908 -5.9927 -5.9921 -5.8795 -5.8793
-5.8645 -5.8642 -1.1815 -1.1782 -1.1047 -1.1016 -0.9530 -0.9380
-0.8195 -0.8168 -0.5381 -0.5135 0.3824 0.3886 0.6049 0.6105
0.7610 0.7641 0.9286 0.9331 0.9699 0.9762 0.9846 1.0024
1.6535 1.6604 2.3461 2.3524 2.9580 2.9932 3.0800 3.1166
3.2026 3.2052 4.3851 4.4224 4.5610 4.5934 4.6167 4.6204
6.0655 6.0755 6.3529 6.3607 6.4793 6.4804 6.7855 6.7903
8.6922 8.6977 9.2030 9.2086 9.6476 9.6506 10.5117 10.5201
10.8243 10.8294
k = 0.0000 0.0000 0.0000 ( 7209 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1915 -7.1915 -5.9924 -5.9924 -5.8789 -5.8789
-5.8639 -5.8639 -1.1799 -1.1799 -1.1033 -1.1033 -0.9456 -0.9456
-0.8182 -0.8182 -0.5258 -0.5258 0.3853 0.3853 0.6079 0.6079
0.7629 0.7629 0.9318 0.9318 0.9769 0.9769 0.9884 0.9884
1.6564 1.6564 2.3515 2.3515 2.9775 2.9775 3.0969 3.0969
3.1993 3.1993 4.4057 4.4057 4.5831 4.5831 4.6108 4.6108
6.0745 6.0745 6.3687 6.3687 6.5007 6.5007 6.7544 6.7544
8.6909 8.6909 9.2018 9.2018 9.6517 9.6517 10.5152 10.5152
10.8268 10.8268
k = 0.0000 0.0000 0.0000 ( 7209 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1915 -7.1915 -5.9924 -5.9924 -5.8789 -5.8789
-5.8639 -5.8639 -1.1799 -1.1799 -1.1033 -1.1033 -0.9456 -0.9456
-0.8182 -0.8182 -0.5258 -0.5258 0.3853 0.3853 0.6079 0.6079
0.7629 0.7629 0.9318 0.9318 0.9769 0.9769 0.9884 0.9884
1.6564 1.6564 2.3515 2.3515 2.9775 2.9775 3.0969 3.0969
3.1993 3.1993 4.4057 4.4057 4.5831 4.5831 4.6108 4.6108
6.0745 6.0745 6.3687 6.3687 6.5007 6.5007 6.7544 6.7544
8.6909 8.6909 9.2018 9.2018 9.6517 9.6517 10.5152 10.5152
10.8268 10.8268
k = 0.0179 0.0126 0.0000 ( 7229 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1908 -7.1908 -5.9935 -5.9935 -5.8789 -5.8789
-5.8639 -5.8639 -1.1828 -1.1828 -1.1007 -1.1007 -0.9455 -0.9455
-0.8183 -0.8183 -0.5254 -0.5254 0.3858 0.3858 0.6077 0.6077
0.7628 0.7628 0.9313 0.9313 0.9757 0.9757 0.9891 0.9891
1.6569 1.6569 2.3517 2.3517 2.9789 2.9789 3.0981 3.0981
3.2005 3.2005 4.4071 4.4071 4.5843 4.5843 4.6123 4.6123
6.0636 6.0636 6.3578 6.3578 6.4977 6.4977 6.7744 6.7744
8.6906 8.6906 9.2034 9.2034 9.6455 9.6455 10.5128 10.5128
10.8208 10.8208
k = 0.0357 0.0252 0.0000 ( 7245 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1886 -7.1886 -5.9970 -5.9970 -5.8789 -5.8789
-5.8640 -5.8640 -1.1904 -1.1904 -1.0939 -1.0939 -0.9451 -0.9451
-0.8185 -0.8185 -0.5241 -0.5241 0.3874 0.3874 0.6068 0.6068
0.7624 0.7624 0.9297 0.9297 0.9728 0.9728 0.9906 0.9906
1.6586 1.6586 2.3523 2.3523 2.9828 2.9828 3.1017 3.1017
3.2040 3.2040 4.4110 4.4110 4.5879 4.5879 4.6166 4.6166
6.0316 6.0316 6.3318 6.3318 6.4887 6.4887 6.8270 6.8270
8.6899 8.6899 9.2083 9.2083 9.6272 9.6272 10.5055 10.5055
10.8030 10.8030
k = 0.0536 0.0379 0.0000 ( 7268 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1850 -7.1850 -6.0027 -6.0027 -5.8789 -5.8789
-5.8641 -5.8641 -1.2009 -1.2009 -1.0847 -1.0847 -0.9444 -0.9444
-0.8188 -0.8188 -0.5219 -0.5219 0.3900 0.3900 0.6055 0.6055
0.7617 0.7617 0.9272 0.9272 0.9690 0.9690 0.9922 0.9922
1.6614 1.6614 2.3533 2.3533 2.9892 2.9892 3.1077 3.1077
3.2099 3.2099 4.4175 4.4175 4.5940 4.5940 4.6238 4.6239
5.9811 5.9811 6.3007 6.3007 6.4738 6.4738 6.8996 6.8996
8.6887 8.6887 9.2164 9.2164 9.5976 9.5976 10.4926 10.4926
10.7738 10.7738
k = 0.0714 0.0505 0.0000 ( 7268 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1799 -7.1799 -6.0107 -6.0107 -5.8790 -5.8790
-5.8643 -5.8643 -1.2129 -1.2129 -1.0746 -1.0746 -0.9433 -0.9433
-0.8193 -0.8193 -0.5190 -0.5190 0.3937 0.3937 0.6038 0.6038
0.7607 0.7607 0.9237 0.9237 0.9648 0.9648 0.9935 0.9935
1.6652 1.6652 2.3548 2.3548 2.9980 2.9980 3.1160 3.1160
3.2180 3.2180 4.4265 4.4265 4.6024 4.6024 4.6338 4.6338
5.9168 5.9168 6.2689 6.2689 6.4533 6.4533 6.9835 6.9835
8.6869 8.6869 9.2275 9.2275 9.5577 9.5577 10.4731 10.4731
10.7337 10.7337
k = 0.0893 0.0631 0.0000 ( 7260 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1733 -7.1733 -6.0208 -6.0208 -5.8790 -5.8790
-5.8646 -5.8646 -1.2257 -1.2257 -1.0643 -1.0643 -0.9420 -0.9420
-0.8200 -0.8200 -0.5154 -0.5154 0.3984 0.3984 0.6017 0.6017
0.7592 0.7592 0.9195 0.9195 0.9604 0.9604 0.9943 0.9943
1.6699 1.6699 2.3569 2.3569 3.0091 3.0091 3.1265 3.1265
3.2283 3.2283 4.4379 4.4379 4.6132 4.6132 4.6463 4.6463
5.8433 5.8433 6.2369 6.2369 6.4273 6.4273 7.0738 7.0738
8.6845 8.6845 9.2415 9.2415 9.5091 9.5091 10.4459 10.4459
10.6839 10.6839
k = 0.1071 0.0757 0.0000 ( 7268 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1653 -7.1653 -6.0331 -6.0331 -5.8791 -5.8791
-5.8649 -5.8649 -1.2386 -1.2386 -1.0543 -1.0543 -0.9403 -0.9403
-0.8209 -0.8209 -0.5113 -0.5113 0.4041 0.4041 0.5994 0.5994
0.7571 0.7571 0.9148 0.9148 0.9558 0.9558 0.9948 0.9948
1.6756 1.6756 2.3595 2.3595 3.0220 3.0220 3.1391 3.1391
3.2408 3.2408 4.4516 4.4516 4.6264 4.6264 4.6613 4.6613
5.7645 5.7645 6.2036 6.2036 6.3964 6.3964 7.1677 7.1677
8.6813 8.6813 9.2581 9.2581 9.4536 9.4536 10.4102 10.4102
10.6253 10.6254
k = 0.1250 0.0884 0.0000 ( 7272 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1559 -7.1559 -6.0474 -6.0474 -5.8791 -5.8791
-5.8652 -5.8652 -1.2515 -1.2515 -1.0450 -1.0450 -0.9382 -0.9382
-0.8219 -0.8219 -0.5066 -0.5066 0.4107 0.4107 0.5969 0.5969
0.7544 0.7544 0.9097 0.9097 0.9513 0.9513 0.9947 0.9948
1.6821 1.6821 2.3627 2.3627 3.0366 3.0366 3.1538 3.1538
3.2553 3.2553 4.4675 4.4675 4.6417 4.6417 4.6786 4.6786
5.6833 5.6833 6.1684 6.1684 6.3607 6.3607 7.2636 7.2636
8.6771 8.6771 9.2764 9.2764 9.3932 9.3932 10.3656 10.3657
10.5596 10.5596
k = 0.1429 0.1010 0.0000 ( 7284 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1452 -7.1452 -6.0637 -6.0637 -5.8792 -5.8792
-5.8656 -5.8656 -1.2641 -1.2641 -1.0364 -1.0364 -0.9359 -0.9359
-0.8232 -0.8232 -0.5017 -0.5017 0.4182 0.4182 0.5944 0.5944
0.7511 0.7511 0.9045 0.9045 0.9469 0.9469 0.9943 0.9943
1.6893 1.6893 2.3667 2.3667 3.0524 3.0524 3.1704 3.1704
3.2717 3.2717 4.4853 4.4853 4.6591 4.6591 4.6980 4.6980
5.6015 5.6015 6.1308 6.1308 6.3209 6.3210 7.3604 7.3604
8.6716 8.6716 9.2908 9.2908 9.3355 9.3355 10.3124 10.3125
10.4881 10.4881
k = 0.1607 0.1136 0.0000 ( 7280 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1330 -7.1330 -6.0819 -6.0819 -5.8792 -5.8792
-5.8660 -5.8660 -1.2763 -1.2763 -1.0286 -1.0286 -0.9331 -0.9331
-0.8247 -0.8247 -0.4967 -0.4967 0.4265 0.4265 0.5919 0.5919
0.7471 0.7471 0.8992 0.8992 0.9426 0.9426 0.9936 0.9936
1.6971 1.6971 2.3716 2.3716 3.0691 3.0691 3.1888 3.1888
3.2899 3.2899 4.5049 4.5049 4.6785 4.6785 4.7194 4.7194
5.5204 5.5204 6.0908 6.0908 6.2774 6.2774 7.4573 7.4573
8.6643 8.6644 9.2520 9.2520 9.3309 9.3309 10.2515 10.2515
10.4122 10.4122
k = 0.1786 0.1262 0.0000 ( 7276 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1195 -7.1195 -6.1017 -6.1017 -5.8793 -5.8793
-5.8665 -5.8665 -1.2880 -1.2880 -1.0217 -1.0217 -0.9301 -0.9301
-0.8264 -0.8264 -0.4916 -0.4916 0.4354 0.4354 0.5896 0.5896
0.7424 0.7424 0.8941 0.8941 0.9386 0.9386 0.9925 0.9925
1.7055 1.7055 2.3773 2.3773 3.0861 3.0861 3.2089 3.2089
3.3098 3.3098 4.5261 4.5261 4.6996 4.6996 4.7424 4.7425
5.4410 5.4410 6.0483 6.0483 6.2307 6.2307 7.5536 7.5536
8.6548 8.6548 9.1872 9.1872 9.3541 9.3541 10.1841 10.1841
10.3333 10.3333
k = 0.1964 0.1389 0.0000 ( 7276 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.1048 -7.1048 -6.1233 -6.1233 -5.8793 -5.8793
-5.8670 -5.8670 -1.2991 -1.2991 -1.0156 -1.0156 -0.9268 -0.9268
-0.8284 -0.8284 -0.4867 -0.4867 0.4446 0.4446 0.5876 0.5876
0.7373 0.7373 0.8890 0.8890 0.9349 0.9349 0.9913 0.9913
1.7143 1.7143 2.3840 2.3840 3.1030 3.1030 3.2305 3.2305
3.3312 3.3312 4.5485 4.5485 4.7222 4.7223 4.7670 4.7671
5.3643 5.3643 6.0038 6.0038 6.1812 6.1812 7.6488 7.6488
8.6422 8.6422 9.1223 9.1223 9.3805 9.3805 10.1118 10.1119
10.2525 10.2525
k = 0.2143 0.1515 0.0000 ( 7284 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.0887 -7.0887 -6.1463 -6.1463 -5.8794 -5.8794
-5.8676 -5.8676 -1.3096 -1.3096 -1.0103 -1.0103 -0.9233 -0.9233
-0.8305 -0.8305 -0.4821 -0.4821 0.4539 0.4539 0.5861 0.5861
0.7319 0.7319 0.8842 0.8842 0.9316 0.9316 0.9898 0.9898
1.7236 1.7236 2.3919 2.3919 3.1190 3.1190 3.2536 3.2536
3.3538 3.3538 4.5719 4.5719 4.7462 4.7462 4.7929 4.7930
5.2910 5.2910 5.9573 5.9573 6.1295 6.1295 7.7421 7.7421
8.6256 8.6256 9.0611 9.0611 9.4082 9.4082 10.0365 10.0365
10.1709 10.1709
k = 0.2321 0.1641 0.0000 ( 7300 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.0715 -7.0715 -6.1706 -6.1706 -5.8794 -5.8794
-5.8681 -5.8681 -1.3195 -1.3195 -1.0057 -1.0057 -0.9196 -0.9196
-0.8329 -0.8329 -0.4779 -0.4779 0.4630 0.4630 0.5850 0.5850
0.7265 0.7265 0.8796 0.8796 0.9287 0.9287 0.9883 0.9883
1.7331 1.7331 2.4010 2.4010 3.1336 3.1336 3.2781 3.2781
3.3776 3.3776 4.5958 4.5958 4.7711 4.7711 4.8199 4.8199
5.2219 5.2219 5.9094 5.9094 6.0761 6.0761 7.8330 7.8330
8.6039 8.6039 9.0061 9.0061 9.4364 9.4364 9.9596 9.9596
10.0894 10.0895
k = 0.2500 0.1767 0.0000 ( 7268 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.0531 -7.0531 -6.1962 -6.1962 -5.8794 -5.8794
-5.8687 -5.8687 -1.3287 -1.3287 -1.0018 -1.0018 -0.9158 -0.9158
-0.8354 -0.8354 -0.4741 -0.4741 0.4716 0.4716 0.5845 0.5845
0.7214 0.7214 0.8753 0.8753 0.9263 0.9263 0.9867 0.9867
1.7429 1.7429 2.4114 2.4114 3.1460 3.1460 3.3037 3.3037
3.4022 3.4022 4.6199 4.6199 4.7967 4.7967 4.8477 4.8477
5.1579 5.1579 5.8603 5.8603 6.0215 6.0215 7.9206 7.9206
8.5764 8.5764 8.9594 8.9594 9.4641 9.4641 9.8827 9.8828
10.0091 10.0091
k = 0.2679 0.1894 0.0000 ( 7280 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.0336 -7.0336 -6.2229 -6.2229 -5.8794 -5.8794
-5.8693 -5.8693 -1.3373 -1.3373 -0.9983 -0.9983 -0.9119 -0.9119
-0.8381 -0.8381 -0.4709 -0.4709 0.4794 0.4794 0.5844 0.5844
0.7168 0.7168 0.8712 0.8712 0.9242 0.9242 0.9851 0.9851
1.7528 1.7528 2.4232 2.4232 3.1558 3.1558 3.3304 3.3304
3.4273 3.4273 4.6435 4.6435 4.8224 4.8224 4.8758 4.8759
5.1001 5.1001 5.8104 5.8104 5.9661 5.9661 8.0035 8.0035
8.5439 8.5439 8.9221 8.9221 9.4905 9.4905 9.8073 9.8073
9.9307 9.9307
k = 0.2857 0.2020 0.0000 ( 7268 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -7.0130 -7.0130 -6.2504 -6.2504 -5.8794 -5.8794
-5.8699 -5.8699 -1.3451 -1.3451 -0.9953 -0.9953 -0.9081 -0.9081
-0.8408 -0.8408 -0.4683 -0.4683 0.4860 0.4860 0.5846 0.5846
0.7131 0.7131 0.8677 0.8677 0.9223 0.9223 0.9837 0.9837
1.7627 1.7627 2.4366 2.4366 3.1623 3.1623 3.3579 3.3579
3.4528 3.4528 4.6661 4.6661 4.8476 4.8476 4.9037 4.9037
5.0502 5.0502 5.7603 5.7603 5.9105 5.9105 8.0798 8.0798
8.5085 8.5085 8.8944 8.8944 9.5141 9.5141 9.7348 9.7348
9.8555 9.8555
k = 0.3036 0.2146 0.0000 ( 7280 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7161 -14.7161
-14.7095 -14.7095 -6.9916 -6.9916 -6.2787 -6.2787 -5.8793 -5.8793
-5.8706 -5.8706 -1.3523 -1.3523 -0.9927 -0.9927 -0.9044 -0.9044
-0.8437 -0.8437 -0.4662 -0.4662 0.4916 0.4916 0.5849 0.5849
0.7104 0.7104 0.8647 0.8647 0.9205 0.9205 0.9824 0.9824
1.7724 1.7724 2.4514 2.4514 3.1652 3.1652 3.3859 3.3859
3.4783 3.4783 4.6866 4.6866 4.8707 4.8707 4.9292 4.9292
5.0124 5.0125 5.7103 5.7104 5.8552 5.8552 8.1454 8.1454
8.4753 8.4753 8.8757 8.8757 9.5319 9.5319 9.6675 9.6676
9.7849 9.7849
k = 0.3214 0.2272 0.0000 ( 7280 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7160 -14.7160
-14.7095 -14.7095 -6.9692 -6.9692 -6.3076 -6.3076 -5.8792 -5.8792
-5.8712 -5.8712 -1.3588 -1.3588 -0.9904 -0.9904 -0.9007 -0.9007
-0.8465 -0.8465 -0.4647 -0.4647 0.4960 0.4960 0.5850 0.5850
0.7090 0.7090 0.8624 0.8624 0.9188 0.9188 0.9813 0.9813
1.7820 1.7820 2.4678 2.4678 3.1641 3.1641 3.4140 3.4141
3.5035 3.5035 4.7038 4.7038 4.8873 4.8874 4.9458 4.9458
4.9982 4.9982 5.6610 5.6610 5.8005 5.8005 8.1929 8.1929
8.4531 8.4532 8.8649 8.8649 9.5353 9.5353 9.6119 9.6119
9.7219 9.7219
k = 0.3393 0.2398 0.0000 ( 7272 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7160 -14.7160
-14.7095 -14.7095 -6.9462 -6.9462 -6.3367 -6.3367 -5.8791 -5.8791
-5.8718 -5.8718 -1.3647 -1.3647 -0.9884 -0.9884 -0.8972 -0.8972
-0.8494 -0.8494 -0.4636 -0.4636 0.4994 0.4994 0.5846 0.5846
0.7086 0.7086 0.8609 0.8609 0.9170 0.9170 0.9805 0.9805
1.7911 1.7911 2.4857 2.4857 3.1590 3.1590 3.4419 3.4419
3.5279 3.5279 4.7161 4.7161 4.8901 4.8901 4.9562 4.9562
5.0134 5.0134 5.6128 5.6128 5.7469 5.7469 8.2120 8.2120
8.4530 8.4530 8.8614 8.8614 9.5067 9.5067 9.5784 9.5784
9.6742 9.6742
k = 0.3571 0.2525 0.0000 ( 7268 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7160 -14.7160
-14.7095 -14.7095 -6.9227 -6.9227 -6.3660 -6.3660 -5.8790 -5.8790
-5.8724 -5.8724 -1.3699 -1.3699 -0.9866 -0.9866 -0.8939 -0.8939
-0.8522 -0.8522 -0.4629 -0.4629 0.5019 0.5019 0.5837 0.5838
0.7092 0.7092 0.8604 0.8604 0.9149 0.9149 0.9800 0.9800
1.7998 1.7998 2.5049 2.5049 3.1502 3.1502 3.4691 3.4691
3.5512 3.5512 4.7219 4.7219 4.8845 4.8845 4.9739 4.9740
5.0396 5.0396 5.5661 5.5661 5.6948 5.6948 8.2027 8.2027
8.4753 8.4753 8.8650 8.8650 9.4585 9.4585 9.5450 9.5450
9.6522 9.6522
k = 0.3750 0.2651 0.0000 ( 7280 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7160 -14.7160
-14.7095 -14.7095 -6.8988 -6.8988 -6.3950 -6.3950 -5.8788 -5.8788
-5.8730 -5.8730 -1.3744 -1.3744 -0.9850 -0.9850 -0.8907 -0.8907
-0.8550 -0.8550 -0.4625 -0.4625 0.5038 0.5038 0.5824 0.5824
0.7104 0.7104 0.8608 0.8608 0.9126 0.9126 0.9798 0.9798
1.8078 1.8078 2.5251 2.5251 3.1379 3.1379 3.4951 3.4951
3.5730 3.5730 4.7210 4.7210 4.8818 4.8818 4.9956 4.9956
5.0683 5.0683 5.5217 5.5217 5.6447 5.6447 8.1775 8.1775
8.5073 8.5074 8.8759 8.8759 9.4097 9.4097 9.5015 9.5015
9.6476 9.6476
k = 0.3929 0.2777 0.0000 ( 7276 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7160 -14.7160
-14.7095 -14.7095 -6.8750 -6.8750 -6.4235 -6.4235 -5.8787 -5.8787
-5.8736 -5.8736 -1.3783 -1.3783 -0.9837 -0.9837 -0.8877 -0.8877
-0.8577 -0.8577 -0.4624 -0.4624 0.5052 0.5053 0.5806 0.5806
0.7119 0.7119 0.8623 0.8623 0.9100 0.9100 0.9798 0.9798
1.8150 1.8150 2.5460 2.5460 3.1229 3.1229 3.5194 3.5194
3.5928 3.5928 4.7152 4.7152 4.8844 4.8844 5.0181 5.0181
5.0973 5.0974 5.4800 5.4800 5.5968 5.5968 8.1472 8.1472
8.5385 8.5385 8.8936 8.8936 9.3650 9.3650 9.4575 9.4575
9.6469 9.6469
k = 0.4107 0.2903 0.0000 ( 7268 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7160 -14.7160
-14.7095 -14.7095 -6.8516 -6.8516 -6.4509 -6.4509 -5.8784 -5.8784
-5.8742 -5.8742 -1.3816 -1.3816 -0.9825 -0.9825 -0.8849 -0.8849
-0.8603 -0.8603 -0.4625 -0.4625 0.5063 0.5063 0.5787 0.5787
0.7134 0.7134 0.8646 0.8646 0.9070 0.9070 0.9799 0.9799
1.8214 1.8214 2.5669 2.5669 3.1060 3.1060 3.5413 3.5413
3.6102 3.6103 4.7073 4.7074 4.8904 4.8904 5.0402 5.0402
5.1258 5.1259 5.4420 5.4420 5.5516 5.5516 8.1174 8.1174
8.5639 8.5639 8.9169 8.9169 9.3259 9.3259 9.4178 9.4178
9.6449 9.6449
k = 0.4286 0.3030 0.0000 ( 7244 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7160 -14.7160
-14.7095 -14.7095 -6.8294 -6.8294 -6.4765 -6.4765 -5.8782 -5.8782
-5.8747 -5.8747 -1.3843 -1.3843 -0.9816 -0.9816 -0.8823 -0.8823
-0.8627 -0.8627 -0.4627 -0.4627 0.5071 0.5071 0.5768 0.5768
0.7147 0.7147 0.8676 0.8676 0.9037 0.9037 0.9802 0.9802
1.8267 1.8267 2.5869 2.5869 3.0887 3.0887 3.5604 3.5604
3.6249 3.6249 4.6995 4.6995 4.8976 4.8976 5.0612 5.0612
5.1529 5.1529 5.4088 5.4088 5.5094 5.5094 8.0909 8.0909
8.5826 8.5826 8.9432 8.9432 9.2929 9.2929 9.3843 9.3843
9.6409 9.6409
k = 0.4464 0.3156 0.0000 ( 7224 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7160 -14.7160
-14.7095 -14.7095 -6.8092 -6.8092 -6.4993 -6.4993 -5.8779 -5.8779
-5.8753 -5.8753 -1.3863 -1.3863 -0.9808 -0.9808 -0.8799 -0.8799
-0.8650 -0.8650 -0.4629 -0.4629 0.5077 0.5077 0.5752 0.5752
0.7157 0.7157 0.8711 0.8711 0.9002 0.9002 0.9805 0.9805
1.8310 1.8310 2.6048 2.6048 3.0724 3.0724 3.5761 3.5761
3.6366 3.6366 4.6928 4.6928 4.9044 4.9044 5.0804 5.0804
5.1772 5.1772 5.3821 5.3821 5.4709 5.4709 8.0693 8.0693
8.5953 8.5953 8.9692 8.9692 9.2665 9.2665 9.3579 9.3579
9.6353 9.6353
k = 0.4643 0.3282 0.0000 ( 7216 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7160 -14.7160
-14.7095 -14.7095 -6.7925 -6.7925 -6.5179 -6.5179 -5.8776 -5.8775
-5.8757 -5.8757 -1.3878 -1.3878 -0.9803 -0.9803 -0.8777 -0.8777
-0.8672 -0.8672 -0.4631 -0.4631 0.5081 0.5081 0.5739 0.5739
0.7164 0.7164 0.8748 0.8748 0.8967 0.8967 0.9808 0.9808
1.8340 1.8340 2.6192 2.6192 3.0588 3.0588 3.5878 3.5878
3.6451 3.6451 4.6879 4.6879 4.9097 4.9097 5.0967 5.0967
5.1965 5.1965 5.3646 5.3646 5.4370 5.4370 8.0533 8.0533
8.6033 8.6033 8.9912 8.9912 9.2469 9.2469 9.3389 9.3389
9.6295 9.6295
k = 0.4821 0.3408 0.0000 ( 7224 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7160 -14.7160
-14.7095 -14.7095 -6.7813 -6.7813 -6.5303 -6.5303 -5.8772 -5.8772
-5.8762 -5.8762 -1.3887 -1.3887 -0.9800 -0.9800 -0.8759 -0.8759
-0.8690 -0.8690 -0.4633 -0.4633 0.5083 0.5083 0.5731 0.5731
0.7168 0.7168 0.8780 0.8780 0.8936 0.8936 0.9810 0.9810
1.8359 1.8359 2.6287 2.6287 3.0498 3.0498 3.5950 3.5950
3.6501 3.6501 4.6848 4.6848 4.9131 4.9131 5.1080 5.1080
5.2085 5.2085 5.3581 5.3581 5.4106 5.4106 8.0435 8.0435
8.6077 8.6077 9.0061 9.0061 9.2348 9.2348 9.3277 9.3277
9.6252 9.6252
k = 0.5000 0.3535 0.0000 ( 7200 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7160 -14.7160
-14.7095 -14.7095 -6.7772 -6.7772 -6.5347 -6.5347 -5.8770 -5.8770
-5.8764 -5.8764 -1.3890 -1.3890 -0.9799 -0.9799 -0.8750 -0.8750
-0.8698 -0.8698 -0.4633 -0.4633 0.5084 0.5084 0.5728 0.5728
0.7170 0.7170 0.8795 0.8795 0.8922 0.8922 0.9811 0.9811
1.8365 1.8365 2.6320 2.6320 3.0466 3.0466 3.5974 3.5974
3.6518 3.6518 4.6838 4.6838 4.9143 4.9143 5.1122 5.1122
5.2123 5.2123 5.3583 5.3583 5.3990 5.3990 8.0402 8.0402
8.6090 8.6090 9.0113 9.0113 9.2307 9.2307 9.3239 9.3239
9.6235 9.6235
k = 0.5000 0.3535 0.0000 ( 7200 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7160 -14.7160
-14.7095 -14.7095 -6.7772 -6.7772 -6.5347 -6.5347 -5.8770 -5.8770
-5.8764 -5.8764 -1.3890 -1.3890 -0.9799 -0.9799 -0.8750 -0.8750
-0.8698 -0.8698 -0.4633 -0.4633 0.5084 0.5084 0.5728 0.5728
0.7170 0.7170 0.8795 0.8795 0.8922 0.8922 0.9811 0.9811
1.8365 1.8365 2.6320 2.6320 3.0466 3.0466 3.5974 3.5974
3.6518 3.6518 4.6838 4.6838 4.9143 4.9143 5.1122 5.1122
5.2123 5.2123 5.3583 5.3583 5.3990 5.3990 8.0402 8.0402
8.6090 8.6090 9.0113 9.0113 9.2307 9.2307 9.3239 9.3239
9.6235 9.6235
k = 0.4911 0.3661 0.0155 ( 7226 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7160 -14.7160
-14.7095 -14.7095 -6.7770 -6.7768 -6.5344 -6.5341 -5.8780 -5.8775
-5.8768 -5.8764 -1.3907 -1.3868 -0.9817 -0.9781 -0.8826 -0.8732
-0.8682 -0.8666 -0.4751 -0.4498 0.5040 0.5117 0.5658 0.5807
0.7162 0.7183 0.8743 0.8794 0.8888 0.8995 0.9739 0.9903
1.8355 1.8382 2.6279 2.6310 3.0429 3.0505 3.5961 3.5995
3.6510 3.6534 4.6758 4.6869 4.9022 4.9214 5.1021 5.1213
5.2100 5.2154 5.3447 5.3709 5.3947 5.4062 8.0407 8.0453
8.6099 8.6121 9.0048 9.0107 9.2261 9.2421 9.3227 9.3311
9.6157 9.6448
k = 0.4821 0.3787 0.0309 ( 7224 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7615 -14.7160 -14.7160
-14.7095 -14.7095 -6.7762 -6.7757 -6.5331 -6.5326 -5.8806 -5.8799
-5.8775 -5.8763 -1.3919 -1.3842 -0.9837 -0.9766 -0.8907 -0.8765
-0.8652 -0.8607 -0.4849 -0.4350 0.4985 0.5139 0.5601 0.5892
0.7159 0.7201 0.8666 0.8737 0.8918 0.9065 0.9689 1.0014
1.8352 1.8405 2.6186 2.6248 3.0394 3.0546 3.5954 3.6019
3.6511 3.6556 4.6635 4.6845 4.8861 4.9228 5.0920 5.1284
5.2080 5.2185 5.3323 5.3779 5.3923 5.4200 8.0467 8.0558
8.6146 8.6191 8.9922 9.0038 9.2265 9.2602 9.3299 9.3424
9.6224 9.6781
k = 0.4732 0.3914 0.0464 ( 7236 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7615 -14.7160 -14.7160
-14.7095 -14.7095 -6.7747 -6.7740 -6.5309 -6.5302 -5.8850 -5.8840
-5.8782 -5.8763 -1.3927 -1.3812 -0.9857 -0.9753 -0.8990 -0.8801
-0.8636 -0.8547 -0.4927 -0.4190 0.4920 0.5152 0.5558 0.5978
0.7163 0.7224 0.8568 0.8682 0.8954 0.9123 0.9662 1.0142
1.8355 1.8435 2.6044 2.6139 3.0361 3.0588 3.5944 3.6037
3.6530 3.6589 4.6478 4.6769 4.8670 4.9184 5.0821 5.1330
5.2044 5.2202 5.3218 5.3782 5.3947 5.4405 8.0581 8.0714
8.6235 8.6302 8.9755 8.9931 9.2297 9.2821 9.3470 9.3577
9.6436 9.7219
k = 0.4643 0.4040 0.0619 ( 7258 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7615 -14.7160 -14.7160
-14.7095 -14.7095 -6.7726 -6.7716 -6.5279 -6.5269 -5.8911 -5.8897
-5.8790 -5.8764 -1.3931 -1.3778 -0.9878 -0.9743 -0.9074 -0.8840
-0.8627 -0.8491 -0.4981 -0.4022 0.4847 0.5156 0.5529 0.6062
0.7174 0.7250 0.8464 0.8631 0.8985 0.9169 0.9658 1.0282
1.8364 1.8472 2.5859 2.5988 3.0330 3.0631 3.5924 3.6036
3.6574 3.6638 4.6295 4.6645 4.8460 4.9085 5.0724 5.1349
5.1968 5.2185 5.3137 5.3764 5.4031 5.4648 8.0744 8.0917
8.6365 8.6456 8.9570 8.9810 9.2342 9.3036 9.3737 9.3796
9.6782 9.7751
k = 0.4553 0.4166 0.0774 ( 7266 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7615 -14.7161 -14.7160
-14.7095 -14.7095 -6.7699 -6.7687 -6.5239 -6.5227 -5.8988 -5.8971
-5.8798 -5.8766 -1.3929 -1.3739 -0.9900 -0.9738 -0.9157 -0.8879
-0.8625 -0.8439 -0.5012 -0.3849 0.4769 0.5153 0.5514 0.6140
0.7190 0.7280 0.8359 0.8583 0.9007 0.9204 0.9677 1.0432
1.8379 1.8516 2.5635 2.5798 3.0302 3.0676 3.5882 3.6009
3.6646 3.6706 4.6095 4.6483 4.8240 4.8938 5.0621 5.1331
5.1829 5.2121 5.3096 5.3766 5.4168 5.4914 8.0952 8.1159
8.6540 8.6655 8.9384 8.9697 9.2400 9.3213 9.4072 9.4128
9.7245 9.8365
k = 0.4464 0.4293 0.0928 ( 7272 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7615 -14.7161 -14.7160
-14.7095 -14.7095 -6.7667 -6.7653 -6.5191 -6.5176 -5.9080 -5.9060
-5.8808 -5.8769 -1.3923 -1.3696 -0.9922 -0.9740 -0.9236 -0.8921
-0.8631 -0.8390 -0.5019 -0.3673 0.4688 0.5143 0.5509 0.6210
0.7212 0.7315 0.8258 0.8537 0.9018 0.9231 0.9717 1.0588
1.8401 1.8567 2.5379 2.5578 3.0277 3.0721 3.5813 3.5955
3.6740 3.6793 4.5886 4.6293 4.8017 4.8753 5.0500 5.1250
5.1642 5.2009 5.3102 5.3808 5.4348 5.5192 8.1198 8.1435
8.6758 8.6901 8.9209 8.9605 9.2470 9.3350 9.4471 9.4563
9.7804 9.9056
k = 0.4375 0.4419 0.1083 ( 7262 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7615 -14.7161 -14.7160
-14.7095 -14.7095 -6.7630 -6.7613 -6.5133 -6.5117 -5.9186 -5.9162
-5.8819 -5.8774 -1.3913 -1.3649 -0.9945 -0.9751 -0.9309 -0.8964
-0.8641 -0.8344 -0.5005 -0.3497 0.4608 0.5129 0.5511 0.6270
0.7235 0.7355 0.8165 0.8493 0.9016 0.9254 0.9771 1.0746
1.8429 1.8624 2.5096 2.5334 3.0256 3.0768 3.5715 3.5876
3.6848 3.6893 4.5676 4.6088 4.7796 4.8536 5.0351 5.1045
5.1473 5.1862 5.3155 5.3890 5.4560 5.5477 8.1477 8.1738
8.7021 8.7190 8.9059 8.9542 9.2553 9.3462 9.4944 9.5067
9.8444 9.9817
k = 0.4286 0.4545 0.1238 ( 7284 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7615 -14.7161 -14.7160
-14.7095 -14.7095 -6.7589 -6.7570 -6.5067 -6.5048 -5.9305 -5.9278
-5.8831 -5.8780 -1.3898 -1.3598 -0.9969 -0.9775 -0.9372 -0.9010
-0.8654 -0.8301 -0.4971 -0.3324 0.4531 0.5112 0.5518 0.6321
0.7253 0.7404 0.8084 0.8450 0.9003 0.9277 0.9835 1.0904
1.8463 1.8688 2.4795 2.5070 3.0240 3.0815 3.5588 3.5774
3.6961 3.7001 4.5472 4.5880 4.7580 4.8294 5.0166 5.0710
5.1343 5.1695 5.3249 5.4006 5.4793 5.5765 8.1783 8.2062
8.7323 8.7511 8.8952 8.9515 9.2647 9.3562 9.5483 9.5628
9.9154 10.0644
k = 0.4196 0.4672 0.1392 ( 7280 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7545 -14.7617 -14.7615 -14.7161 -14.7160
-14.7095 -14.7095 -6.7544 -6.7523 -6.4993 -6.4972 -5.9435 -5.9406
-5.8844 -5.8787 -1.3878 -1.3543 -0.9993 -0.9811 -0.9423 -0.9059
-0.8667 -0.8259 -0.4920 -0.3157 0.4457 0.5093 0.5528 0.6362
0.7262 0.7462 0.8018 0.8410 0.8979 0.9302 0.9906 1.1059
1.8502 1.8758 2.4480 2.4794 3.0229 3.0864 3.5433 3.5649
3.7075 3.7110 4.5281 4.5679 4.7370 4.8027 4.9944 5.0308
5.1211 5.1517 5.3378 5.4148 5.5039 5.6050 8.2112 8.2404
8.7658 8.7825 8.8927 8.9530 9.2751 9.3657 9.6082 9.6239
9.9925 10.1531
k = 0.4107 0.4798 0.1547 ( 7284 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7545 -14.7617 -14.7615 -14.7161 -14.7160
-14.7095 -14.7094 -6.7497 -6.7474 -6.4911 -6.4887 -5.9576 -5.9543
-5.8858 -5.8795 -1.3853 -1.3484 -1.0019 -0.9861 -0.9462 -0.9111
-0.8677 -0.8218 -0.4854 -0.2996 0.4387 0.5072 0.5538 0.6394
0.7257 0.7531 0.7969 0.8372 0.8947 0.9327 0.9979 1.1207
1.8547 1.8833 2.4157 2.4510 3.0226 3.0915 3.5254 3.5503
3.7182 3.7212 4.5109 4.5495 4.7162 4.7735 4.9679 4.9898
5.1059 5.1331 5.3538 5.4312 5.5289 5.6330 8.2459 8.2760
8.7996 8.8060 8.9065 8.9599 9.2865 9.3749 9.6736 9.6896
10.0749 10.2475
k = 0.4018 0.4924 0.1702 ( 7280 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7545 -14.7617 -14.7615 -14.7161 -14.7160
-14.7095 -14.7094 -6.7448 -6.7423 -6.4820 -6.4794 -5.9725 -5.9689
-5.8873 -5.8804 -1.3824 -1.3421 -1.0047 -0.9919 -0.9494 -0.9165
-0.8682 -0.8179 -0.4776 -0.2846 0.4323 0.5051 0.5547 0.6420
0.7240 0.7608 0.7937 0.8337 0.8907 0.9352 1.0054 1.1346
1.8596 1.8913 2.3833 2.4223 3.0230 3.0968 3.5051 3.5336
3.7280 3.7301 4.4959 4.5337 4.6942 4.7418 4.9324 4.9573
5.0888 5.1131 5.3723 5.4492 5.5538 5.6602 8.2822 8.3128
8.8107 8.8365 8.9414 8.9741 9.2988 9.3842 9.7439 9.7597
10.1623 10.3470
k = 0.3928 0.5051 0.1856 ( 7286 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7545 -14.7617 -14.7615 -14.7161 -14.7160
-14.7095 -14.7094 -6.7399 -6.7372 -6.4722 -6.4694 -5.9881 -5.9841
-5.8889 -5.8815 -1.3790 -1.3355 -1.0080 -0.9981 -0.9520 -0.9221
-0.8682 -0.8142 -0.4689 -0.2708 0.4265 0.5031 0.5552 0.6441
0.7212 0.7690 0.7919 0.8306 0.8863 0.9378 1.0128 1.1473
1.8650 1.8996 2.3511 2.3936 3.0245 3.1024 3.4827 3.5152
3.7360 3.7376 4.4834 4.5210 4.6690 4.7079 4.8915 4.9343
5.0701 5.0913 5.3928 5.4685 5.5782 5.6863 8.3197 8.3508
8.8094 8.8659 8.9893 8.9995 9.3121 9.3939 9.8188 9.8338
10.2542 10.4512
k = 0.3839 0.5177 0.2011 ( 7292 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7545 -14.7617 -14.7616 -14.7161 -14.7160
-14.7095 -14.7094 -6.7351 -6.7322 -6.4616 -6.4586 -6.0040 -5.9997
-5.8906 -5.8827 -1.3751 -1.3285 -1.0120 -1.0039 -0.9545 -0.9276
-0.8675 -0.8105 -0.4595 -0.2584 0.4212 0.5010 0.5551 0.6459
0.7178 0.7775 0.7909 0.8283 0.8813 0.9404 1.0201 1.1586
1.8706 1.9081 2.3195 2.3653 3.0270 3.1084 3.4587 3.4951
3.7412 3.7440 4.4734 4.5121 4.6376 4.6726 4.8542 4.9166
5.0501 5.0675 5.4145 5.4889 5.6017 5.7110 8.3584 8.3898
8.8046 8.8880 9.0318 9.0493 9.3266 9.4043 9.8977 9.9117
10.3500 10.5595
k = 0.3750 0.5303 0.2166 ( 7296 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7545 -14.7617 -14.7616 -14.7161 -14.7160
-14.7095 -14.7094 -6.7306 -6.7275 -6.4502 -6.4471 -6.0202 -6.0155
-5.8924 -5.8839 -1.3708 -1.3212 -1.0173 -1.0087 -0.9569 -0.9330
-0.8661 -0.8071 -0.4497 -0.2476 0.4165 0.4991 0.5544 0.6473
0.7146 0.7858 0.7899 0.8270 0.8761 0.9430 1.0271 1.1683
1.8765 1.9167 2.2890 2.3375 3.0308 3.1149 3.4332 3.4737
3.7438 3.7490 4.4647 4.5070 4.6000 4.6353 4.8247 4.9036
5.0294 5.0423 5.4368 5.5099 5.6240 5.7341 8.3979 8.4298
8.7988 8.9030 9.0772 9.1102 9.3425 9.4159 9.9800 9.9930
10.4493 10.6712
k = 0.3660 0.5429 0.2321 ( 7316 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7545 -14.7617 -14.7616 -14.7161 -14.7160
-14.7094 -14.7094 -6.7265 -6.7233 -6.4382 -6.4349 -6.0363 -6.0313
-5.8942 -5.8853 -1.3661 -1.3136 -1.0235 -1.0126 -0.9594 -0.9382
-0.8642 -0.8038 -0.4396 -0.2387 0.4124 0.4972 0.5529 0.6484
0.7118 0.7883 0.7936 0.8274 0.8708 0.9455 1.0340 1.1763
1.8824 1.9252 2.2598 2.3106 3.0359 3.1217 3.4067 3.4514
3.7440 3.7523 4.4545 4.5056 4.5601 4.5946 4.8048 4.8948
5.0088 5.0166 5.4591 5.5311 5.6449 5.7555 8.4381 8.4704
8.7925 8.9132 9.1282 9.1739 9.3599 9.4291 10.0651 10.0773
10.5513 10.7856
k = 0.3571 0.5556 0.2475 ( 7320 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7617 -14.7616 -14.7161 -14.7160
-14.7094 -14.7094 -6.7231 -6.7198 -6.4256 -6.4220 -6.0521 -6.0468
-5.8961 -5.8868 -1.3610 -1.3057 -1.0300 -1.0161 -0.9619 -0.9431
-0.8617 -0.8007 -0.4294 -0.2316 0.4089 0.4955 0.5506 0.6491
0.7101 0.7856 0.8003 0.8297 0.8660 0.9481 1.0407 1.1825
1.8883 1.9334 2.2321 2.2845 3.0423 3.1288 3.3798 3.4286
3.7421 3.7539 4.4358 4.5062 4.5227 4.5552 4.7937 4.8892
4.9881 4.9931 5.4808 5.5521 5.6640 5.7751 8.4786 8.5113
8.7864 8.9200 9.1823 9.2388 9.3792 9.4442 10.1522 10.1642
10.6555 10.9017
k = 0.3482 0.5682 0.2630 ( 7324 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7094 -6.7205 -6.7171 -6.4122 -6.4086 -6.0673 -6.0616
-5.8981 -5.8884 -1.3554 -1.2976 -1.0365 -1.0195 -0.9646 -0.9475
-0.8587 -0.7977 -0.4194 -0.2267 0.4058 0.4938 0.5477 0.6490
0.7095 0.7815 0.8057 0.8331 0.8625 0.9506 1.0471 1.1869
1.8939 1.9413 2.2061 2.2594 3.0501 3.1359 3.3530 3.4057
3.7384 3.7541 4.4023 4.4779 4.5108 4.5330 4.7894 4.8854
4.9659 4.9771 5.5011 5.5724 5.6813 5.7927 8.5188 8.5519
8.7808 8.9246 9.2373 9.3035 9.4007 9.4616 10.2405 10.2531
10.7606 11.0179
k = 0.3393 0.5808 0.2785 ( 7320 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7094 -6.7190 -6.7155 -6.3983 -6.3945 -6.0816 -6.0755
-5.9001 -5.8900 -1.3495 -1.2892 -1.0427 -1.0229 -0.9673 -0.9514
-0.8553 -0.7950 -0.4096 -0.2240 0.4033 0.4922 0.5443 0.6482
0.7101 0.7764 0.8097 0.8357 0.8622 0.9530 1.0535 1.1895
1.8992 1.9485 2.1819 2.2353 3.0591 3.1424 3.3271 3.3832
3.7336 3.7533 4.3575 4.4275 4.5124 4.5297 4.7899 4.8818
4.9468 4.9686 5.5194 5.5915 5.6966 5.8082 8.5582 8.5912
8.7767 8.9278 9.2915 9.3665 9.4248 9.4813 10.3291 10.3430
10.8654 11.1312
k = 0.3303 0.5935 0.2939 ( 7308 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7094 -6.7189 -6.7153 -6.3839 -6.3798 -6.0947 -6.0883
-5.9021 -5.8918 -1.3432 -1.2806 -1.0487 -1.0263 -0.9701 -0.9549
-0.8515 -0.7926 -0.4003 -0.2235 0.4011 0.4906 0.5407 0.6466
0.7114 0.7706 0.8127 0.8358 0.8663 0.9554 1.0597 1.1904
1.9040 1.9551 2.1596 2.2122 3.0691 3.1474 3.3031 3.3619
3.7280 3.7518 4.3081 4.3741 4.5133 4.5325 4.7938 4.8780
4.9343 4.9680 5.5353 5.6086 5.7100 5.8215 8.5957 8.6272
8.7756 8.9304 9.3436 9.4254 9.4532 9.5036 10.4168 10.4329
10.9672 11.2341
k = 0.3214 0.6061 0.3094 ( 7318 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7094 -6.7202 -6.7166 -6.3689 -6.3646 -6.1063 -6.0996
-5.9042 -5.8936 -1.3366 -1.2719 -1.0542 -1.0297 -0.9728 -0.9580
-0.8475 -0.7904 -0.3914 -0.2253 0.3994 0.4889 0.5372 0.6441
0.7126 0.7649 0.8141 0.8348 0.8737 0.9577 1.0658 1.1898
1.9083 1.9609 2.1391 2.1900 3.0798 3.1493 3.2825 3.3426
3.7220 3.7500 4.2575 4.3203 4.5125 4.5343 4.8009 4.8758
4.9301 4.9750 5.5485 5.6231 5.7215 5.8324 8.6298 8.6571
8.7807 8.9333 9.3926 9.4707 9.4942 9.5284 10.5022 10.5212
11.0615 11.3066
k = 0.3125 0.6187 0.3249 ( 7326 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7093 -6.7233 -6.7197 -6.3534 -6.3490 -6.1161 -6.1091
-5.9063 -5.8954 -1.3297 -1.2630 -1.0594 -1.0332 -0.9754 -0.9607
-0.8432 -0.7885 -0.3833 -0.2293 0.3980 0.4870 0.5342 0.6410
0.7124 0.7605 0.8136 0.8349 0.8825 0.9599 1.0718 1.1878
1.9119 1.9658 2.1203 2.1686 3.0907 3.1461 3.2662 3.3269
3.7160 3.7482 4.2079 4.2675 4.5081 4.5322 4.8116 4.8784
4.9346 4.9878 5.5585 5.6345 5.7311 5.8408 8.6579 8.6790
8.7950 8.9377 9.4377 9.5046 9.5440 9.5565 10.5833 10.6061
11.1387 11.3258
k = 0.3125 0.6187 0.3249 ( 7326 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7093 -6.7233 -6.7197 -6.3534 -6.3490 -6.1161 -6.1091
-5.9063 -5.8954 -1.3297 -1.2630 -1.0594 -1.0332 -0.9754 -0.9607
-0.8432 -0.7885 -0.3833 -0.2293 0.3980 0.4870 0.5342 0.6410
0.7124 0.7605 0.8136 0.8349 0.8825 0.9599 1.0718 1.1878
1.9119 1.9658 2.1203 2.1686 3.0907 3.1461 3.2662 3.3269
3.7160 3.7482 4.2079 4.2675 4.5081 4.5322 4.8116 4.8784
4.9346 4.9878 5.5585 5.6345 5.7311 5.8408 8.6579 8.6790
8.7950 8.9377 9.4377 9.5046 9.5440 9.5565 10.5833 10.6061
11.1387 11.3258
k = 0.2929 0.6132 0.3316 ( 7324 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7093 -6.7259 -6.7223 -6.3459 -6.3415 -6.1194 -6.1122
-5.9075 -5.8965 -1.3264 -1.2591 -1.0616 -1.0346 -0.9766 -0.9616
-0.8411 -0.7878 -0.3801 -0.2321 0.3978 0.4860 0.5329 0.6392
0.7114 0.7586 0.8133 0.8360 0.8868 0.9608 1.0739 1.1863
1.9133 1.9675 2.1135 2.1599 3.0921 3.1408 3.2616 3.3224
3.7136 3.7479 4.1848 4.2422 4.5078 4.5330 4.8191 4.8833
4.9392 4.9940 5.5562 5.6324 5.7409 5.8469 8.6666 8.6864
8.8043 8.9381 9.4566 9.5180 9.5676 9.5766 10.6172 10.6415
11.1646 11.3214
k = 0.2734 0.6077 0.3384 ( 7330 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7093 -6.7301 -6.7265 -6.3377 -6.3332 -6.1210 -6.1137
-5.9090 -5.8979 -1.3226 -1.2551 -1.0639 -1.0359 -0.9780 -0.9623
-0.8387 -0.7870 -0.3774 -0.2361 0.3981 0.4849 0.5315 0.6366
0.7095 0.7557 0.8135 0.8385 0.8915 0.9615 1.0753 1.1843
1.9150 1.9689 2.1085 2.1520 3.0868 3.1310 3.2598 3.3203
3.7113 3.7483 4.1595 4.2136 4.5124 4.5387 4.8302 4.8922
4.9449 4.9989 5.5448 5.6209 5.7583 5.8568 8.6698 8.6925
8.8170 8.9364 9.4754 9.5323 9.5956 9.6076 10.6504 10.6752
11.1862 11.3144
k = 0.2539 0.6022 0.3452 ( 7325 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7093 -6.7352 -6.7318 -6.3295 -6.3250 -6.1210 -6.1135
-5.9110 -5.8999 -1.3184 -1.2511 -1.0661 -1.0373 -0.9795 -0.9629
-0.8360 -0.7862 -0.3750 -0.2410 0.3991 0.4838 0.5298 0.6332
0.7069 0.7522 0.8146 0.8419 0.8965 0.9620 1.0763 1.1818
1.9172 1.9703 2.1051 2.1447 3.0754 3.1179 3.2596 3.3196
3.7085 3.7491 4.1348 4.1849 4.5208 4.5478 4.8443 4.9039
4.9520 5.0025 5.5287 5.6044 5.7768 5.8672 8.6656 8.6965
8.8344 8.9365 9.4947 9.5499 9.6291 9.6434 10.6826 10.7071
11.2029 11.3081
k = 0.2344 0.5967 0.3519 ( 7333 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.7411 -6.7379 -6.3217 -6.3173 -6.1190 -6.1113
-5.9135 -5.9023 -1.3138 -1.2473 -1.0683 -1.0386 -0.9808 -0.9635
-0.8330 -0.7855 -0.3729 -0.2470 0.4007 0.4828 0.5277 0.6286
0.7040 0.7481 0.8163 0.8462 0.9014 0.9622 1.0771 1.1789
1.9201 1.9719 2.1029 2.1378 3.0598 3.1025 3.2597 3.3186
3.7047 3.7496 4.1129 4.1586 4.5318 4.5590 4.8600 4.9167
4.9614 5.0053 5.5110 5.5857 5.7928 5.8756 8.6554 8.6960
8.8562 8.9415 9.5159 9.5708 9.6664 9.6826 10.7133 10.7373
11.2139 11.3036
k = 0.2148 0.5911 0.3587 ( 7335 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.7474 -6.7443 -6.3148 -6.3105 -6.1150 -6.1071
-5.9166 -5.9053 -1.3088 -1.2438 -1.0702 -1.0401 -0.9819 -0.9641
-0.8299 -0.7849 -0.3711 -0.2537 0.4029 0.4820 0.5254 0.6228
0.7012 0.7439 0.8186 0.8509 0.9061 0.9620 1.0783 1.1757
1.9241 1.9739 2.1014 2.1313 3.0423 3.0856 3.2585 3.3161
3.6997 3.7495 4.0956 4.1368 4.5444 4.5713 4.8750 4.9296
4.9727 5.0104 5.4933 5.5662 5.8045 5.8803 8.6415 8.6896
8.8811 8.9533 9.5397 9.5944 9.7053 9.7259 10.7421 10.7659
11.2192 11.3006
k = 0.1953 0.5856 0.3655 ( 7328 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.7537 -6.7509 -6.3090 -6.3050 -6.1090 -6.1009
-5.9202 -5.9089 -1.3035 -1.2406 -1.0719 -1.0418 -0.9827 -0.9648
-0.8265 -0.7843 -0.3694 -0.2612 0.4058 0.4814 0.5226 0.6156
0.6986 0.7397 0.8215 0.8558 0.9102 0.9612 1.0801 1.1724
1.9291 1.9765 2.1004 2.1249 3.0243 3.0682 3.2551 3.3108
3.6940 3.7482 4.0833 4.1207 4.5577 4.5839 4.8857 4.9441
4.9805 5.0243 5.4770 5.5470 5.8107 5.8804 8.6259 8.6778
8.9083 8.9714 9.5659 9.6196 9.7446 9.7736 10.7683 10.7934
11.2199 11.2983
k = 0.1758 0.5801 0.3722 ( 7329 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.7600 -6.7574 -6.3045 -6.3008 -6.1011 -6.0928
-5.9244 -5.9131 -1.2980 -1.2379 -1.0732 -1.0436 -0.9831 -0.9656
-0.8231 -0.7839 -0.3678 -0.2693 0.4093 0.4810 0.5196 0.6070
0.6967 0.7356 0.8249 0.8608 0.9136 0.9599 1.0828 1.1691
1.9351 1.9798 2.0995 2.1186 3.0070 3.0509 3.2489 3.3023
3.6884 3.7457 4.0762 4.1106 4.5712 4.5964 4.8903 4.9578
4.9871 5.0480 5.4629 5.5292 5.8109 5.8753 8.6100 8.6623
8.9369 8.9937 9.5940 9.6452 9.7851 9.8255 10.7914 10.8202
11.2169 11.2955
k = 0.1562 0.5746 0.3790 ( 7323 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.7659 -6.7636 -6.3011 -6.2978 -6.0918 -6.0833
-5.9292 -5.9180 -1.2923 -1.2358 -1.0741 -1.0456 -0.9833 -0.9665
-0.8195 -0.7837 -0.3661 -0.2778 0.4135 0.4808 0.5163 0.5973
0.6954 0.7316 0.8287 0.8655 0.9162 0.9581 1.0866 1.1656
1.9420 1.9836 2.0985 2.1124 2.9913 3.0342 3.2402 3.2903
3.6837 3.7420 4.0737 4.1060 4.5842 4.6082 4.8906 4.9605
5.0049 5.0766 5.4521 5.5136 5.8049 5.8648 8.5949 8.6450
8.9659 9.0181 9.6227 9.6699 9.8276 9.8808 10.8111 10.8464
11.2111 11.2920
k = 0.1367 0.5690 0.3857 ( 7331 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.7714 -6.7694 -6.2987 -6.2959 -6.0812 -6.0725
-5.9347 -5.9235 -1.2864 -1.2344 -1.0746 -1.0478 -0.9832 -0.9675
-0.8159 -0.7838 -0.3643 -0.2864 0.4183 0.4809 0.5130 0.5867
0.6949 0.7278 0.8328 0.8697 0.9181 0.9558 1.0914 1.1622
1.9498 1.9879 2.0969 2.1063 2.9777 3.0186 3.2294 3.2755
3.6806 3.7374 4.0751 4.1057 4.5962 4.6188 4.8889 4.9554
5.0307 5.1060 5.4455 5.5015 5.7928 5.8489 8.5813 8.6275
8.9947 9.0425 9.6508 9.6927 9.8731 9.9389 10.8272 10.8716
11.2027 11.2880
k = 0.1172 0.5635 0.3925 ( 7326 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.7764 -6.7746 -6.2972 -6.2947 -6.0698 -6.0610
-5.9408 -5.9297 -1.2804 -1.2338 -1.0747 -1.0502 -0.9827 -0.9686
-0.8123 -0.7841 -0.3623 -0.2952 0.4236 0.4810 0.5097 0.5756
0.6950 0.7241 0.8372 0.8731 0.9195 0.9531 1.0971 1.1588
1.9580 1.9926 2.0945 2.1008 2.9664 3.0044 3.2174 3.2586
3.6793 3.7322 4.0796 4.1083 4.6070 4.6279 4.8869 4.9481
5.0580 5.1334 5.4445 5.4945 5.7750 5.8279 8.5697 8.6107
9.0224 9.0655 9.6769 9.7128 9.9220 9.9982 10.8401 10.8950
11.1914 11.2840
k = 0.0976 0.5580 0.3993 ( 7323 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7093 -14.7093 -6.7807 -6.7792 -6.2962 -6.2942 -6.0580 -6.0490
-5.9475 -5.9366 -1.2744 -1.2340 -1.0742 -1.0527 -0.9820 -0.9697
-0.8088 -0.7847 -0.3600 -0.3038 0.4295 0.4809 0.5070 0.5643
0.6957 0.7206 0.8419 0.8753 0.9208 0.9502 1.1033 1.1553
1.9665 1.9973 2.0907 2.0964 2.9577 2.9917 3.2053 3.2408
3.6797 3.7265 4.0863 4.1123 4.6163 4.6350 4.8859 4.9403
5.0842 5.1558 5.4504 5.4941 5.7520 5.8022 8.5604 8.5954
9.0481 9.0859 9.7002 9.7298 9.9740 10.0567 10.8500 10.9158
11.1771 11.2800
k = 0.0781 0.5525 0.4060 ( 7322 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7093 -14.7093 -6.7843 -6.7831 -6.2956 -6.2940 -6.0461 -6.0371
-5.9547 -5.9441 -1.2685 -1.2351 -1.0733 -1.0553 -0.9812 -0.9710
-0.8053 -0.7857 -0.3572 -0.3121 0.4359 0.4799 0.5055 0.5533
0.6969 0.7172 0.8468 0.8761 0.9223 0.9470 1.1098 1.1516
1.9750 2.0015 2.0862 2.0928 2.9516 2.9805 3.1942 3.2235
3.6816 3.7207 4.0942 4.1167 4.6239 4.6400 4.8865 4.9327
5.1075 5.1713 5.4637 5.5019 5.7247 5.7723 8.5535 8.5820
9.0712 9.1027 9.7199 9.7433 10.0276 10.1111 10.8581 10.9327
11.1605 11.2745
k = 0.0586 0.5469 0.4128 ( 7319 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7093 -14.7093 -6.7871 -6.7862 -6.2953 -6.2941 -6.0344 -6.0256
-5.9623 -5.9522 -1.2628 -1.2371 -1.0719 -1.0580 -0.9801 -0.9722
-0.8019 -0.7870 -0.3539 -0.3200 0.4426 0.4776 0.5057 0.5428
0.6985 0.7140 0.8517 0.8754 0.9244 0.9437 1.1163 1.1478
1.9831 2.0048 2.0822 2.0894 2.9481 2.9709 3.1853 3.2078
3.6846 3.7149 4.1023 4.1202 4.6299 4.6427 4.8890 4.9254
5.1274 5.1792 5.4842 5.5182 5.6945 5.7391 8.5490 8.5706
9.0909 9.1154 9.7359 9.7533 10.0804 10.1569 10.8662 10.9440
11.1434 11.2486
k = 0.0391 0.5414 0.4196 ( 7325 PWs) bands (ev):
-15.7612 -15.7612 -15.7545 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7093 -14.7093 -6.7891 -6.7885 -6.2951 -6.2943 -6.0234 -6.0152
-5.9695 -5.9606 -1.2573 -1.2398 -1.0702 -1.0606 -0.9789 -0.9736
-0.7987 -0.7887 -0.3500 -0.3273 0.4494 0.4738 0.5078 0.5332
0.7005 0.7109 0.8566 0.8733 0.9270 0.9403 1.1226 1.1436
1.9907 2.0062 2.0797 2.0860 2.9470 2.9629 3.1793 3.1946
3.6886 3.7092 4.1098 4.1224 4.6346 4.6436 4.8932 4.9184
5.1439 5.1801 5.5098 5.5411 5.6636 5.7039 8.5469 8.5614
9.1068 9.1235 9.7482 9.7596 10.1290 10.1888 10.8777 10.9466
11.1291 11.1934
k = 0.0195 0.5359 0.4263 ( 7326 PWs) bands (ev):
-15.7612 -15.7612 -15.7545 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7093 -14.7093 -6.7902 -6.7899 -6.2949 -6.2945 -6.0138 -6.0080
-5.9748 -5.9687 -1.2521 -1.2433 -1.0681 -1.0633 -0.9776 -0.9749
-0.7958 -0.7907 -0.3454 -0.3340 0.4563 0.4688 0.5118 0.5247
0.7028 0.7080 0.8615 0.8700 0.9300 0.9368 1.1286 1.1391
1.9973 2.0055 2.0791 2.0827 2.9482 2.9563 3.1770 3.1848
3.6932 3.7036 4.1160 4.1225 4.6383 4.6429 4.8987 4.9116
5.1573 5.1759 5.5381 5.5632 5.6386 5.6689 8.5471 8.5544
9.1182 9.1267 9.7566 9.7623 10.1689 10.2021 10.8951 10.9372
11.1218 11.1497
k = 0.0000 0.5304 0.4331 ( 7336 PWs) bands (ev):
-15.7612 -15.7612 -15.7545 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7093 -14.7093 -6.7905 -6.7905 -6.2947 -6.2947 -6.0074 -6.0074
-5.9746 -5.9746 -1.2475 -1.2475 -1.0658 -1.0658 -0.9763 -0.9763
-0.7931 -0.7931 -0.3401 -0.3401 0.4628 0.4628 0.5175 0.5175
0.7053 0.7053 0.8660 0.8660 0.9334 0.9334 1.1340 1.1340
2.0024 2.0024 2.0802 2.0802 2.9514 2.9514 3.1789 3.1789
3.6982 3.6982 4.1203 4.1203 4.6410 4.6410 4.9050 4.9050
5.1680 5.1680 5.5625 5.5625 5.6404 5.6404 8.5496 8.5496
9.1249 9.1249 9.7613 9.7613 10.1948 10.1948 10.9174 10.9174
11.1267 11.1267
k = 0.0000 0.5304 0.4331 ( 7336 PWs) bands (ev):
-15.7612 -15.7612 -15.7545 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7093 -14.7093 -6.7905 -6.7905 -6.2947 -6.2947 -6.0074 -6.0074
-5.9746 -5.9746 -1.2475 -1.2475 -1.0658 -1.0658 -0.9763 -0.9763
-0.7931 -0.7931 -0.3401 -0.3401 0.4628 0.4628 0.5175 0.5175
0.7053 0.7053 0.8660 0.8660 0.9334 0.9334 1.1340 1.1340
2.0024 2.0024 2.0802 2.0802 2.9514 2.9514 3.1789 3.1789
3.6982 3.6982 4.1203 4.1203 4.6410 4.6410 4.9050 4.9050
5.1680 5.1680 5.5625 5.5625 5.6404 5.6404 8.5496 8.5496
9.1249 9.1249 9.7613 9.7613 10.1948 10.1948 10.9174 10.9174
11.1267 11.1267
k = 0.0089 0.5177 0.4486 ( 7330 PWs) bands (ev):
-15.7612 -15.7612 -15.7545 -15.7545 -14.7617 -14.7617 -14.7161 -14.7161
-14.7093 -14.7093 -6.7903 -6.7899 -6.2947 -6.2943 -6.0078 -6.0074
-5.9753 -5.9747 -1.2502 -1.2440 -1.0675 -1.0640 -0.9785 -0.9737
-0.7973 -0.7889 -0.3458 -0.3350 0.4612 0.4644 0.5153 0.5204
0.7008 0.7095 0.8626 0.8691 0.9328 0.9344 1.1262 1.1398
1.9905 2.0024 2.0734 2.0844 2.9486 2.9618 3.1769 3.1848
3.6948 3.7039 4.1145 4.1229 4.6357 4.6497 4.9041 4.9111
5.1687 5.1736 5.5604 5.5640 5.6345 5.6460 8.5450 8.5498
9.1169 9.1258 9.7550 9.7627 10.1908 10.2043 10.9135 10.9199
11.1197 11.1398
k = 0.0179 0.5051 0.4640 ( 7326 PWs) bands (ev):
-15.7612 -15.7612 -15.7545 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7093 -14.7093 -6.7895 -6.7887 -6.2941 -6.2935 -6.0085 -6.0076
-5.9767 -5.9755 -1.2523 -1.2399 -1.0691 -1.0620 -0.9804 -0.9708
-0.8014 -0.7846 -0.3523 -0.3306 0.4595 0.4659 0.5136 0.5238
0.6961 0.7134 0.8588 0.8717 0.9328 0.9360 1.1165 1.1433
1.9692 1.9896 2.0651 2.0841 2.9534 2.9789 3.1791 3.1949
3.6937 3.7114 4.1063 4.1221 4.6345 4.6612 4.9087 4.9217
5.1755 5.1852 5.5576 5.5653 5.6281 5.6517 8.5362 8.5455
9.1019 9.1193 9.7438 9.7588 10.1924 10.2190 10.9084 10.9211
11.1189 11.1584
k = 0.0268 0.4925 0.4795 ( 7322 PWs) bands (ev):
-15.7612 -15.7612 -15.7545 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7093 -14.7093 -6.7879 -6.7867 -6.2931 -6.2922 -6.0096 -6.0081
-5.9789 -5.9770 -1.2537 -1.2351 -1.0707 -1.0599 -0.9819 -0.9675
-0.8054 -0.7805 -0.3593 -0.3269 0.4580 0.4673 0.5126 0.5277
0.6912 0.7169 0.8548 0.8739 0.9335 0.9379 1.1050 1.1445
1.9404 1.9660 2.0547 2.0782 2.9646 3.0007 3.1862 3.2094
3.6949 3.7196 4.0974 4.1186 4.6383 4.6752 4.9184 4.9358
5.1878 5.2021 5.5543 5.5664 5.6211 5.6578 8.5236 8.5369
9.0804 9.1056 9.7280 9.7493 10.1993 10.2385 10.9023 10.9210
11.1245 11.1819
k = 0.0357 0.4799 0.4950 ( 7324 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7093 -14.7093 -6.7857 -6.7841 -6.2917 -6.2904 -6.0110 -6.0090
-5.9818 -5.9792 -1.2544 -1.2298 -1.0722 -1.0577 -0.9830 -0.9640
-0.8093 -0.7765 -0.3669 -0.3241 0.4565 0.4685 0.5124 0.5320
0.6862 0.7199 0.8506 0.8757 0.9347 0.9401 1.0922 1.1435
1.9060 1.9345 2.0406 2.0665 2.9801 3.0241 3.1992 3.2286
3.6976 3.7276 4.0900 4.1142 4.6474 4.6918 4.9324 4.9527
5.2044 5.2234 5.5503 5.5678 5.6135 5.6649 8.5078 8.5246
9.0529 9.0851 9.7072 9.7338 10.2110 10.2622 10.8956 10.9200
11.1361 11.2089
k = 0.0446 0.4672 0.5104 ( 7320 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7093 -14.7093 -6.7828 -6.7808 -6.2898 -6.2882 -6.0129 -6.0101
-5.9854 -5.9820 -1.2543 -1.2239 -1.0736 -1.0552 -0.9838 -0.9602
-0.8130 -0.7727 -0.3750 -0.3220 0.4552 0.4695 0.5127 0.5367
0.6811 0.7225 0.8462 0.8769 0.9364 0.9427 1.0784 1.1404
1.8677 1.8976 2.0222 2.0495 2.9975 3.0457 3.2196 3.2527
3.7013 3.7340 4.0863 4.1108 4.6619 4.7112 4.9496 4.9718
5.2236 5.2480 5.5458 5.5699 5.6057 5.6735 8.4897 8.5090
9.0202 9.0584 9.6813 9.7121 10.2272 10.2891 10.8887 10.9187
11.1533 11.2356
k = 0.0536 0.4546 0.5259 ( 7316 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7161
-14.7093 -14.7093 -6.7792 -6.7768 -6.2874 -6.2855 -6.0152 -6.0117
-5.9897 -5.9854 -1.2536 -1.2176 -1.0750 -1.0525 -0.9842 -0.9562
-0.8165 -0.7691 -0.3835 -0.3206 0.4541 0.4704 0.5138 0.5417
0.6760 0.7244 0.8416 0.8776 0.9386 0.9454 1.0641 1.1353
1.8266 1.8569 1.9995 2.0277 3.0144 3.0625 3.2479 3.2818
3.7055 3.7382 4.0883 4.1107 4.6814 4.7335 4.9691 4.9927
5.2435 5.2743 5.5410 5.5726 5.5986 5.6842 8.4700 8.4911
8.9828 9.0262 9.6500 9.6839 10.2470 10.3186 10.8822 10.9177
11.1748 11.2525
k = 0.0625 0.4420 0.5414 ( 7330 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.7750 -6.7722 -6.2847 -6.2825 -6.0180 -6.0135
-5.9945 -5.9891 -1.2522 -1.2109 -1.0764 -1.0495 -0.9843 -0.9520
-0.8198 -0.7660 -0.3924 -0.3200 0.4532 0.4711 0.5155 0.5470
0.6710 0.7257 0.8369 0.8779 0.9410 0.9483 1.0496 1.1285
1.7840 1.8140 1.9730 2.0019 3.0285 3.0731 3.2834 3.3154
3.7101 3.7406 4.0969 4.1159 4.7055 4.7585 4.9901 5.0152
5.2624 5.3006 5.5362 5.5736 5.5957 5.6976 8.4495 8.4715
8.9414 8.9892 9.6133 9.6495 10.2697 10.3497 10.8768 10.9176
11.1991 11.2573
k = 0.0714 0.4293 0.5568 ( 7320 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.7702 -6.7670 -6.2815 -6.2790 -6.0214 -6.0159
-5.9997 -5.9932 -1.2500 -1.2038 -1.0777 -1.0462 -0.9840 -0.9476
-0.8228 -0.7633 -0.4015 -0.3202 0.4525 0.4717 0.5178 0.5524
0.6660 0.7264 0.8321 0.8777 0.9434 0.9512 1.0356 1.1201
1.7408 1.7698 1.9430 1.9727 3.0379 3.0772 3.3241 3.3531
3.7156 3.7427 4.1118 4.1278 4.7334 4.7858 5.0117 5.0390
5.2790 5.3247 5.5319 5.5694 5.6021 5.7139 8.4288 8.4510
8.8966 8.9482 9.5711 9.6090 10.2945 10.3817 10.8730 10.9187
11.2242 11.2587
k = 0.0804 0.4167 0.5723 ( 7318 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.7648 -6.7613 -6.2780 -6.2753 -6.0256 -6.0189
-6.0051 -5.9974 -1.2473 -1.1964 -1.0790 -1.0425 -0.9835 -0.9432
-0.8256 -0.7611 -0.4109 -0.3209 0.4520 0.4723 0.5207 0.5579
0.6613 0.7262 0.8272 0.8770 0.9455 0.9539 1.0228 1.1106
1.6977 1.7254 1.9102 1.9409 3.0411 3.0752 3.3676 3.3939
3.7231 3.7465 4.1320 4.1469 4.7647 4.8148 5.0335 5.0634
5.2926 5.3448 5.5285 5.5631 5.6164 5.7332 8.4086 8.4304
8.8492 8.9041 9.5237 9.5628 10.3205 10.4138 10.8712 10.9216
11.2465 11.2622
k = 0.0893 0.4041 0.5878 ( 7320 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.7590 -6.7551 -6.2742 -6.2712 -6.0305 -6.0228
-6.0105 -6.0016 -1.2439 -1.1890 -1.0802 -1.0384 -0.9826 -0.9387
-0.8281 -0.7596 -0.4205 -0.3223 0.4517 0.4728 0.5241 0.5635
0.6568 0.7252 0.8221 0.8758 0.9471 0.9557 1.0123 1.1003
1.6554 1.6814 1.8751 1.9071 3.0371 3.0674 3.4120 3.4372
3.7334 3.7547 4.1564 4.1727 4.7984 4.8446 5.0551 5.0877
5.3030 5.3596 5.5264 5.5581 5.6364 5.7551 8.3894 8.4103
8.7997 8.8575 9.4715 9.5115 10.3470 10.4455 10.8717 10.9266
11.2573 11.2762
k = 0.0982 0.3914 0.6032 ( 7326 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.7526 -6.7484 -6.2700 -6.2668 -6.0361 -6.0279
-6.0153 -6.0059 -1.2399 -1.1815 -1.0813 -1.0338 -0.9815 -0.9342
-0.8303 -0.7588 -0.4301 -0.3242 0.4516 0.4733 0.5279 0.5690
0.6527 0.7234 0.8170 0.8740 0.9477 0.9558 1.0054 1.0896
1.6143 1.6386 1.8384 1.8719 3.0253 3.0543 3.4559 3.4823
3.7470 3.7692 4.1848 4.2032 4.8341 4.8739 5.0760 5.1107
5.3108 5.3688 5.5259 5.5571 5.6611 5.7791 8.3715 8.3911
8.7489 8.8092 9.4150 9.4557 10.3734 10.4761 10.8748 10.9338
11.2625 11.2950
k = 0.1071 0.3788 0.6187 ( 7316 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7618 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.7458 -6.7413 -6.2656 -6.2622 -6.0425 -6.0342
-6.0195 -6.0100 -1.2354 -1.1740 -1.0824 -1.0287 -0.9802 -0.9297
-0.8322 -0.7589 -0.4398 -0.3265 0.4517 0.4739 0.5322 0.5744
0.6490 0.7207 0.8118 0.8716 0.9463 0.9542 1.0028 1.0789
1.5748 1.5977 1.8006 1.8359 3.0062 3.0363 3.4988 3.5283
3.7646 3.7906 4.2163 4.2367 4.8706 4.9012 5.0955 5.1317
5.3170 5.3735 5.5273 5.5614 5.6891 5.8044 8.3551 8.3732
8.6974 8.7599 9.3548 9.3962 10.3989 10.5052 10.8806 10.9435
11.2686 11.3132
k = 0.1161 0.3662 0.6342 ( 7320 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.7387 -6.7339 -6.2609 -6.2574 -6.0494 -6.0414
-6.0233 -6.0141 -1.2304 -1.1668 -1.0835 -1.0231 -0.9787 -0.9253
-0.8338 -0.7598 -0.4495 -0.3291 0.4519 0.4745 0.5368 0.5796
0.6458 0.7170 0.8066 0.8685 0.9417 0.9529 1.0036 1.0689
1.5369 1.5593 1.7622 1.7996 2.9810 3.0138 3.5408 3.5743
3.7868 3.8181 4.2500 4.2718 4.9067 4.9251 5.1124 5.1509
5.3225 5.3752 5.5322 5.5714 5.7189 5.8301 8.3402 8.3567
8.6461 8.7105 9.2915 9.3336 10.4231 10.5324 10.8893 10.9556
11.2764 11.3309
k = 0.1250 0.3536 0.6496 ( 7332 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.7313 -6.7262 -6.2561 -6.2524 -6.0569 -6.0492
-6.0270 -6.0181 -1.2249 -1.1598 -1.0845 -1.0168 -0.9770 -0.9210
-0.8350 -0.7617 -0.4592 -0.3319 0.4523 0.4752 0.5418 0.5845
0.6433 0.7126 0.8013 0.8647 0.9349 0.9521 1.0058 1.0607
1.5009 1.5239 1.7235 1.7635 2.9511 2.9876 3.5820 3.6195
3.8138 3.8505 4.2846 4.3073 4.9356 4.9488 5.1249 5.1699
5.3284 5.3759 5.5418 5.5864 5.7494 5.8554 8.3265 8.3418
8.5959 8.6619 9.2260 9.2688 10.4456 10.5573 10.9007 10.9702
11.2859 11.3488
k = 0.1339 0.3409 0.6651 ( 7314 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.7237 -6.7183 -6.2512 -6.2474 -6.0646 -6.0572
-6.0306 -6.0222 -1.2190 -1.1533 -1.0855 -1.0101 -0.9751 -0.9169
-0.8360 -0.7645 -0.4689 -0.3347 0.4528 0.4759 0.5471 0.5891
0.6415 0.7074 0.7961 0.8602 0.9274 0.9512 1.0071 1.0557
1.4667 1.4919 1.6852 1.7279 2.9180 2.9587 3.6228 3.6632
3.8453 3.8867 4.3188 4.3423 4.9474 4.9781 5.1327 5.1904
5.3358 5.3778 5.5568 5.6056 5.7795 5.8798 8.3132 8.3281
8.5477 8.6152 9.1589 9.2025 10.4660 10.5798 10.9152 10.9872
11.2968 11.3670
k = 0.1429 0.3283 0.6806 ( 7312 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.7159 -6.7103 -6.2462 -6.2423 -6.0725 -6.0654
-6.0343 -6.0263 -1.2129 -1.1472 -1.0865 -1.0027 -0.9731 -0.9129
-0.8366 -0.7681 -0.4785 -0.3374 0.4533 0.4766 0.5527 0.5933
0.6404 0.7015 0.7909 0.8548 0.9197 0.9501 1.0058 1.0553
1.4346 1.4635 1.6476 1.6933 2.8830 2.9278 3.6630 3.7052
3.8810 3.9256 4.3509 4.3760 4.9485 5.0013 5.1398 5.2122
5.3455 5.3831 5.5763 5.6284 5.8081 5.9030 8.2991 8.3154
8.5030 8.5716 9.0911 9.1354 10.4842 10.5997 10.9325 11.0066
11.3089 11.3853
k = 0.1518 0.3157 0.6960 ( 7310 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.7082 -6.7023 -6.2412 -6.2373 -6.0804 -6.0735
-6.0381 -6.0304 -1.2064 -1.1416 -1.0875 -0.9950 -0.9709 -0.9091
-0.8371 -0.7725 -0.4882 -0.3400 0.4539 0.4773 0.5584 0.5972
0.6402 0.6953 0.7858 0.8488 0.9121 0.9488 1.0018 1.0591
1.4050 1.4386 1.6110 1.6601 2.8472 2.8962 3.7024 3.7452
3.9201 3.9666 4.3797 4.4079 4.9408 5.0103 5.1531 5.2336
5.3578 5.3941 5.5987 5.6540 5.8348 5.9250 8.2828 8.3027
8.4634 8.5326 9.0233 9.0684 10.5001 10.6169 10.9527 11.0282
11.3215 11.4034
k = 0.1607 0.3030 0.7115 ( 7314 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.7004 -6.6944 -6.2363 -6.2325 -6.0881 -6.0814
-6.0419 -6.0345 -1.1998 -1.1365 -1.0885 -0.9869 -0.9685 -0.9055
-0.8375 -0.7775 -0.4978 -0.3424 0.4546 0.4780 0.5643 0.6007
0.6406 0.6888 0.7807 0.8421 0.9047 0.9472 0.9967 1.0659
1.3779 1.4170 1.5759 1.6284 2.8116 2.8645 3.7408 3.7829
3.9622 4.0092 4.4040 4.4374 4.9252 5.0031 5.1751 5.2538
5.3721 5.4130 5.6217 5.6816 5.8586 5.9458 8.2634 8.2882
8.4310 8.4999 8.9564 9.0021 10.5136 10.6314 10.9756 11.0520
11.3341 11.4206
k = 0.1696 0.2904 0.7270 ( 7312 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6929 -6.6867 -6.2316 -6.2279 -6.0955 -6.0889
-6.0457 -6.0386 -1.1932 -1.1320 -1.0897 -0.9788 -0.9657 -0.9022
-0.8381 -0.7827 -0.5073 -0.3444 0.4553 0.4787 0.5701 0.6041
0.6415 0.6822 0.7758 0.8348 0.8977 0.9452 0.9917 1.0741
1.3536 1.3986 1.5425 1.5988 2.7771 2.8337 3.7778 3.8182
4.0065 4.0529 4.4231 4.4638 4.9028 4.9834 5.2016 5.2736
5.3882 5.4397 5.6435 5.7101 5.8792 5.9658 8.2406 8.2701
8.4073 8.4747 8.8910 8.9374 10.5249 10.6433 11.0007 11.0780
11.3460 11.4362
k = 0.1786 0.2778 0.7424 ( 7308 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6857 -6.6793 -6.2272 -6.2237 -6.1024 -6.0958
-6.0494 -6.0428 -1.1865 -1.1281 -1.0909 -0.9717 -0.9617 -0.8990
-0.8391 -0.7878 -0.5166 -0.3460 0.4560 0.4792 0.5759 0.6073
0.6427 0.6759 0.7711 0.8269 0.8913 0.9426 0.9877 1.0829
1.3321 1.3833 1.5112 1.5713 2.7443 2.8045 3.8129 3.8512
4.0523 4.0974 4.4371 4.4867 4.8747 4.9561 5.2272 5.2951
5.4065 5.4721 5.6625 5.7381 5.8963 5.9853 8.2152 8.2479
8.3925 8.4572 8.8281 8.8751 10.5340 10.6529 11.0273 11.1061
11.3568 11.4498
k = 0.1875 0.2651 0.7579 ( 7314 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6789 -6.6724 -6.2231 -6.2199 -6.1086 -6.1020
-6.0530 -6.0468 -1.1801 -1.1246 -1.0923 -0.9670 -0.9553 -0.8961
-0.8411 -0.7923 -0.5256 -0.3473 0.4568 0.4797 0.5814 0.6106
0.6439 0.6701 0.7666 0.8185 0.8857 0.9393 0.9850 1.0918
1.3135 1.3707 1.4822 1.5464 2.7138 2.7773 3.8456 3.8815
4.0991 4.1427 4.4459 4.5059 4.8419 4.9241 5.2486 5.3196
5.4275 5.5076 5.6780 5.7639 5.9101 6.0041 8.1892 8.2230
8.3848 8.4463 8.7684 8.8159 10.5412 10.6604 11.0546 11.1365
11.3664 11.4624
k = 0.1964 0.2525 0.7734 ( 7308 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6726 -6.6661 -6.2195 -6.2166 -6.1140 -6.1073
-6.0564 -6.0508 -1.1739 -1.1215 -1.0939 -0.9641 -0.9470 -0.8934
-0.8444 -0.7957 -0.5342 -0.3483 0.4576 0.4801 0.5865 0.6140
0.6446 0.6651 0.7626 0.8101 0.8811 0.9353 0.9836 1.1004
1.2976 1.3607 1.4559 1.5242 2.6863 2.7528 3.8753 3.9091
4.1460 4.1883 4.4501 4.5215 4.8055 4.8894 5.2657 5.3455
5.4514 5.5439 5.6896 5.7855 5.9214 6.0220 8.1643 8.1973
8.3824 8.4408 8.7129 8.7608 10.5467 10.6660 11.0814 11.1690
11.3751 11.4756
k = 0.2054 0.2399 0.7888 ( 7308 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6671 -6.6604 -6.2165 -6.2140 -6.1185 -6.1117
-6.0595 -6.0545 -1.1682 -1.1188 -1.0957 -0.9621 -0.9380 -0.8910
-0.8493 -0.7978 -0.5421 -0.3490 0.4583 0.4804 0.5913 0.6173
0.6445 0.6613 0.7593 0.8017 0.8774 0.9310 0.9833 1.1083
1.2845 1.3532 1.4323 1.5050 2.6622 2.7313 3.9017 3.9335
4.1921 4.2341 4.4500 4.5340 4.7665 4.8535 5.2797 5.3700
5.4780 5.5788 5.6978 5.8011 5.9313 6.0384 8.1422 8.1728
8.3837 8.4392 8.6623 8.7106 10.5508 10.6701 11.1066 11.2027
11.3842 11.4901
k = 0.2143 0.2273 0.8043 ( 7306 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6623 -6.6556 -6.2140 -6.2120 -6.1221 -6.1151
-6.0622 -6.0579 -1.1632 -1.1162 -1.0976 -0.9605 -0.9287 -0.8890
-0.8555 -0.7986 -0.5491 -0.3495 0.4590 0.4807 0.5955 0.6205
0.6434 0.6588 0.7567 0.7938 0.8747 0.9268 0.9837 1.1152
1.2740 1.3481 1.4119 1.4889 2.6419 2.7132 3.9241 3.9544
4.2365 4.2795 4.4462 4.5439 4.7264 4.8180 5.2914 5.3911
5.5063 5.6092 5.7044 5.8093 5.9404 6.0527 8.1240 8.1509
8.3876 8.4402 8.6177 8.6662 10.5536 10.6730 11.1290 11.2360
11.3955 11.5060
k = 0.2232 0.2146 0.8198 ( 7310 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6585 -6.6517 -6.2122 -6.2106 -6.1248 -6.1175
-6.0643 -6.0609 -1.1589 -1.1139 -1.0998 -0.9594 -0.9195 -0.8874
-0.8628 -0.7987 -0.5550 -0.3498 0.4595 0.4808 0.5992 0.6230
0.6420 0.6572 0.7550 0.7866 0.8728 0.9230 0.9845 1.1209
1.2659 1.3452 1.3946 1.4763 2.6257 2.6988 3.9422 3.9714
4.2777 4.3235 4.4390 4.5516 4.6870 4.7848 5.3009 5.4079
5.5350 5.6302 5.7135 5.8098 5.9489 6.0643 8.1101 8.1324
8.3936 8.4426 8.5804 8.6286 10.5555 10.6750 11.1476 11.2659
11.4115 11.5218
k = 0.2321 0.2020 0.8352 ( 7310 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6557 -6.6489 -6.2109 -6.2097 -6.1266 -6.1191
-6.0658 -6.0634 -1.1557 -1.1116 -1.1020 -0.9585 -0.9103 -0.8867
-0.8704 -0.7984 -0.5593 -0.3500 0.4600 0.4810 0.6022 0.6245
0.6411 0.6562 0.7543 0.7807 0.8717 0.9199 0.9853 1.1251
1.2602 1.3444 1.3810 1.4671 2.6140 2.6884 3.9555 3.9839
4.3140 4.3636 4.4292 4.5560 4.6520 4.7562 5.3080 5.4200
5.5623 5.6371 5.7290 5.8031 5.9560 6.0729 8.1009 8.1182
8.4009 8.4448 8.5522 8.5990 10.5567 10.6762 11.1615 11.2886
11.4346 11.5329
k = 0.2411 0.1894 0.8507 ( 7308 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6539 -6.6471 -6.2101 -6.2093 -6.1276 -6.1200
-6.0665 -6.0651 -1.1537 -1.1093 -1.1044 -0.9580 -0.9014 -0.8878
-0.8768 -0.7980 -0.5621 -0.3500 0.4602 0.4810 0.6043 0.6249
0.6409 0.6554 0.7543 0.7766 0.8711 0.9180 0.9858 1.1277
1.2569 1.3450 1.3715 1.4616 2.6069 2.6820 3.9636 3.9916
4.3425 4.3931 4.4199 4.5552 4.6282 4.7361 5.3124 5.4272
5.5858 5.6322 5.7489 5.7907 5.9607 6.0781 8.0961 8.1088
8.4080 8.4453 8.5350 8.5792 10.5574 10.6768 11.1701 11.3019
11.4635 11.5298
k = 0.2500 0.1767 0.8662 ( 7292 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6533 -6.6465 -6.2098 -6.2092 -6.1279 -6.1203
-6.0666 -6.0659 -1.1530 -1.1076 -1.1061 -0.9578 -0.8942 -0.8922
-0.8792 -0.7979 -0.5630 -0.3501 0.4603 0.4811 0.6051 0.6249
0.6410 0.6551 0.7544 0.7752 0.8709 0.9173 0.9860 1.1286
1.2558 1.3457 1.3679 1.4597 2.6045 2.6799 3.9663 3.9942
4.3552 4.3997 4.4196 4.5526 4.6204 4.7287 5.3139 5.4297
5.5980 5.6258 5.7634 5.7791 5.9623 6.0799 8.0948 8.1053
8.4113 8.4448 8.5294 8.5720 10.5576 10.6770 11.1731 11.3062
11.4837 11.5179
k = 0.2500 0.1767 0.8662 ( 7292 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6533 -6.6465 -6.2098 -6.2092 -6.1279 -6.1203
-6.0666 -6.0659 -1.1530 -1.1076 -1.1061 -0.9578 -0.8942 -0.8922
-0.8792 -0.7979 -0.5630 -0.3501 0.4603 0.4811 0.6051 0.6249
0.6410 0.6551 0.7544 0.7752 0.8709 0.9173 0.9860 1.1286
1.2558 1.3457 1.3679 1.4597 2.6045 2.6799 3.9663 3.9942
4.3552 4.3997 4.4196 4.5526 4.6204 4.7287 5.3139 5.4297
5.5980 5.6258 5.7634 5.7791 5.9623 6.0799 8.0948 8.1053
8.4113 8.4448 8.5294 8.5720 10.5576 10.6770 11.1731 11.3062
11.4837 11.5179
k = 0.2647 0.1871 0.8534 ( 7309 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6535 -6.6467 -6.2099 -6.2092 -6.1278 -6.1203
-6.0666 -6.0656 -1.1532 -1.1083 -1.1054 -0.9586 -0.8979 -0.8890
-0.8782 -0.7981 -0.5624 -0.3506 0.4603 0.4810 0.6043 0.6245
0.6414 0.6559 0.7543 0.7758 0.8710 0.9174 0.9855 1.1246
1.2598 1.3460 1.3693 1.4603 2.6079 2.6830 3.9576 3.9844
4.3415 4.3975 4.4281 4.5437 4.6392 4.7349 5.3160 5.4314
5.5944 5.6289 5.7576 5.7844 5.9617 6.0790 8.0848 8.0951
8.4190 8.4537 8.5307 8.5741 10.5595 10.6789 11.1707 11.3034
11.4748 11.5173
k = 0.2794 0.1975 0.8407 ( 7303 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6539 -6.6472 -6.2103 -6.2094 -6.1274 -6.1200
-6.0664 -6.0650 -1.1539 -1.1092 -1.1040 -0.9606 -0.9029 -0.8857
-0.8750 -0.7986 -0.5604 -0.3522 0.4603 0.4810 0.6025 0.6231
0.6424 0.6582 0.7541 0.7778 0.8711 0.9178 0.9841 1.1140
1.2707 1.3471 1.3735 1.4621 2.6179 2.6919 3.9336 3.9579
4.3135 4.3807 4.4462 4.5336 4.6784 4.7533 5.3226 5.4369
5.5865 5.6352 5.7478 5.7927 5.9601 6.0762 8.0570 8.0668
8.4390 8.4765 8.5365 8.5807 10.5651 10.6843 11.1637 11.2958
11.4593 11.5074
k = 0.2941 0.2079 0.8280 ( 7311 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6545 -6.6480 -6.2109 -6.2098 -6.1269 -6.1196
-6.0661 -6.0641 -1.1551 -1.1100 -1.1025 -0.9639 -0.9082 -0.8834
-0.8699 -0.7997 -0.5570 -0.3546 0.4598 0.4813 0.6001 0.6205
0.6441 0.6614 0.7539 0.7812 0.8711 0.9185 0.9818 1.0993
1.2850 1.3495 1.3803 1.4656 2.6341 2.7063 3.8982 3.9200
4.2777 4.3449 4.4686 4.5360 4.7209 4.7806 5.3341 5.4457
5.5775 5.6425 5.7370 5.8002 5.9580 6.0717 8.0173 8.0261
8.4624 8.4992 8.5555 8.5946 10.5743 10.6932 11.1527 11.2843
11.4428 11.4897
k = 0.3088 0.2183 0.8153 ( 7307 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6552 -6.6488 -6.2119 -6.2105 -6.1263 -6.1191
-6.0656 -6.0632 -1.1570 -1.1107 -1.1008 -0.9683 -0.9136 -0.8817
-0.8638 -0.8012 -0.5522 -0.3573 0.4585 0.4825 0.5973 0.6171
0.6460 0.6652 0.7540 0.7859 0.8711 0.9197 0.9790 1.0827
1.2991 1.3538 1.3899 1.4714 2.6559 2.7258 3.8556 3.8755
4.2350 4.2965 4.4918 4.5499 4.7597 4.8122 5.3500 5.4561
5.5691 5.6507 5.7255 5.8067 5.9560 6.0658 7.9712 7.9791
8.4800 8.5093 8.5940 8.6202 10.5864 10.7051 11.1382 11.2699
11.4269 11.4690
k = 0.3235 0.2287 0.8025 ( 7315 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6558 -6.6497 -6.2132 -6.2115 -6.1255 -6.1184
-6.0650 -6.0622 -1.1595 -1.1111 -1.0989 -0.9735 -0.9192 -0.8805
-0.8574 -0.8030 -0.5462 -0.3601 0.4563 0.4846 0.5944 0.6132
0.6476 0.6693 0.7550 0.7917 0.8708 0.9213 0.9760 1.0657
1.3098 1.3606 1.4025 1.4800 2.6828 2.7499 3.8090 3.8282
4.1866 4.2415 4.5139 4.5707 4.7922 4.8443 5.3690 5.4647
5.5626 5.6608 5.7131 5.8128 5.9547 6.0587 7.9225 7.9303
8.4890 8.5118 8.6414 8.6592 10.6011 10.7196 11.1210 11.2533
11.4122 11.4492
k = 0.3382 0.2391 0.7898 ( 7318 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6564 -6.6506 -6.2149 -6.2128 -6.1247 -6.1175
-6.0644 -6.0613 -1.1627 -1.1112 -1.0968 -0.9796 -0.9249 -0.8795
-0.8512 -0.8050 -0.5391 -0.3624 0.4533 0.4877 0.5913 0.6094
0.6483 0.6737 0.7571 0.7986 0.8701 0.9234 0.9731 1.0494
1.3165 1.3689 1.4187 1.4916 2.7140 2.7781 3.7610 3.7805
4.1342 4.1831 4.5343 4.5944 4.8179 4.8749 5.3889 5.4678
5.5588 5.6708 5.7024 5.8194 5.9543 6.0505 7.8739 7.8830
8.4919 8.5106 8.6893 8.7086 10.6176 10.7361 11.1016 11.2351
11.3981 11.4329
k = 0.3529 0.2495 0.7771 ( 7314 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6568 -6.6513 -6.2169 -6.2145 -6.1237 -6.1164
-6.0637 -6.0604 -1.1666 -1.1111 -1.0945 -0.9863 -0.9306 -0.8788
-0.8456 -0.8070 -0.5314 -0.3637 0.4496 0.4916 0.5879 0.6059
0.6480 0.6780 0.7605 0.8063 0.8691 0.9256 0.9705 1.0344
1.3202 1.3766 1.4384 1.5061 2.7490 2.8097 3.7134 3.7342
4.0795 4.1233 4.5523 4.6177 4.8379 4.9029 5.4072 5.4637
5.5563 5.6659 5.7079 5.8278 5.9552 6.0418 7.8280 7.8396
8.4919 8.5074 8.7367 8.7623 10.6353 10.7539 11.0803 11.2154
11.3838 11.4224
k = 0.3676 0.2599 0.7643 ( 7316 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6570 -6.6519 -6.2194 -6.2166 -6.1227 -6.1151
-6.0631 -6.0596 -1.1710 -1.1108 -1.0921 -0.9936 -0.9362 -0.8785
-0.8410 -0.8084 -0.5234 -0.3635 0.4455 0.4961 0.5842 0.6032
0.6467 0.6821 0.7655 0.8148 0.8678 0.9277 0.9684 1.0218
1.3226 1.3831 1.4604 1.5228 2.7869 2.8442 3.6677 3.6904
4.0239 4.0637 4.5670 4.6381 4.8540 4.9285 5.4217 5.4537
5.5523 5.6456 5.7278 5.8389 5.9571 6.0330 7.7869 7.8020
8.4906 8.5032 8.7830 8.8162 10.6534 10.7723 11.0576 11.1939
11.3695 11.4183
k = 0.3824 0.2703 0.7516 ( 7317 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6571 -6.6523 -6.2222 -6.2192 -6.1214 -6.1136
-6.0625 -6.0589 -1.1760 -1.1104 -1.0897 -1.0012 -0.9418 -0.8785
-0.8380 -0.8089 -0.5156 -0.3615 0.4411 0.5009 0.5802 0.6012
0.6447 0.6856 0.7721 0.8238 0.8662 0.9290 0.9668 1.0124
1.3248 1.3886 1.4833 1.5409 2.8271 2.8807 3.6249 3.6500
3.9689 4.0054 4.5778 4.6537 4.8683 4.9525 5.4303 5.4407
5.5449 5.6193 5.7495 5.8524 5.9596 6.0246 7.7526 7.7718
8.4889 8.4989 8.8271 8.8685 10.6709 10.7901 11.0337 11.1701
11.3565 11.4200
k = 0.3971 0.2807 0.7389 ( 7319 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6570 -6.6526 -6.2255 -6.2223 -6.1200 -6.1120
-6.0620 -6.0583 -1.1814 -1.1098 -1.0874 -1.0092 -0.9472 -0.8788
-0.8368 -0.8083 -0.5082 -0.3573 0.4367 0.5058 0.5761 0.5999
0.6421 0.6885 0.7799 0.8329 0.8645 0.9288 0.9654 1.0077
1.3272 1.3939 1.5060 1.5597 2.8686 2.9185 3.5858 3.6138
3.9156 3.9495 4.5838 4.6631 4.8826 4.9757 5.4202 5.4383
5.5332 5.5893 5.7680 5.8667 5.9616 6.0175 7.7268 7.7502
8.4875 8.4956 8.8680 8.9179 10.6869 10.8061 11.0087 11.1432
11.3463 11.4269
k = 0.4118 0.2911 0.7261 ( 7329 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6567 -6.6527 -6.2293 -6.2259 -6.1184 -6.1100
-6.0615 -6.0577 -1.1871 -1.1092 -1.0852 -1.0170 -0.9524 -0.8794
-0.8372 -0.8069 -0.5014 -0.3509 0.4324 0.5106 0.5721 0.5990
0.6394 0.6909 0.7887 0.8418 0.8631 0.9268 0.9640 1.0083
1.3305 1.3994 1.5277 1.5784 2.9105 2.9564 3.5512 3.5821
3.8654 3.8971 4.5846 4.6653 4.8977 4.9985 5.4000 5.4387
5.5164 5.5580 5.7811 5.8793 5.9615 6.0127 7.7105 7.7382
8.4868 8.4943 8.9049 8.9634 10.7003 10.8185 10.9833 11.1128
11.3399 11.4386
k = 0.4265 0.3015 0.7134 ( 7327 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6563 -6.6526 -6.2335 -6.2301 -6.1166 -6.1079
-6.0610 -6.0571 -1.1932 -1.1089 -1.0834 -1.0246 -0.9572 -0.8804
-0.8387 -0.8051 -0.4952 -0.3426 0.4283 0.5151 0.5685 0.5984
0.6367 0.6928 0.7978 0.8487 0.8636 0.9230 0.9631 1.0134
1.3349 1.4055 1.5479 1.5965 2.9517 2.9934 3.5216 3.5554
3.8196 3.8496 4.5801 4.6607 4.9134 5.0210 5.3760 5.4353
5.4925 5.5300 5.7881 5.8882 5.9580 6.0105 7.7043 7.7362
8.4872 8.4959 8.9371 9.0042 10.7099 10.8247 10.9588 11.0786
11.3382 11.4544
k = 0.4412 0.3119 0.7007 ( 7320 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7092 -6.6558 -6.6525 -6.2381 -6.2347 -6.1145 -6.1055
-6.0604 -6.0564 -1.1996 -1.1089 -1.0820 -1.0312 -0.9617 -0.8817
-0.8407 -0.8034 -0.4896 -0.3327 0.4246 0.5192 0.5653 0.5978
0.6345 0.6946 0.8066 0.8508 0.8689 0.9183 0.9634 1.0218
1.3408 1.4128 1.5661 1.6135 2.9907 3.0280 3.4971 3.5336
3.7795 3.8086 4.5707 4.6500 4.9288 5.0427 5.3484 5.4259
5.4630 5.5089 5.7895 5.8923 5.9508 6.0092 7.7079 7.7438
8.4901 8.5008 8.9640 9.0396 10.7141 10.8212 10.9375 11.0412
11.3419 11.4734
k = 0.4559 0.3223 0.6879 ( 7325 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.6554 -6.6523 -6.2432 -6.2399 -6.1121 -6.1029
-6.0597 -6.0556 -1.2061 -1.1098 -1.0812 -1.0366 -0.9658 -0.8832
-0.8430 -0.8019 -0.4843 -0.3217 0.4212 0.5226 0.5626 0.5970
0.6328 0.6964 0.8147 0.8497 0.8770 0.9135 0.9653 1.0321
1.3485 1.4213 1.5823 1.6291 3.0258 3.0587 3.4780 3.5170
3.7468 3.7758 4.5567 4.6342 4.9424 5.0625 5.3171 5.4018
5.4411 5.4929 5.7862 5.8919 5.9406 6.0069 7.7205 7.7600
8.4965 8.5095 8.9854 9.0689 10.7113 10.8059 10.9208 11.0019
11.3516 11.4927
k = 0.4706 0.3327 0.6752 ( 7324 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.6551 -6.6523 -6.2486 -6.2454 -6.1094 -6.1000
-6.0588 -6.0546 -1.2127 -1.1119 -1.0807 -1.0403 -0.9694 -0.8849
-0.8454 -0.8008 -0.4792 -0.3103 0.4183 0.5252 0.5605 0.5961
0.6318 0.6983 0.8214 0.8479 0.8845 0.9097 0.9688 1.0434
1.3583 1.4316 1.5964 1.6432 3.0551 3.0839 3.4642 3.5054
3.7229 3.7528 4.5387 4.6141 4.9522 5.0785 5.2826 5.3649
5.4291 5.4802 5.7792 5.8883 5.9278 6.0025 7.7405 7.7829
8.5075 8.5225 9.0008 9.0915 10.6996 10.7807 10.9058 10.9627
11.3676 11.5051
k = 0.4853 0.3431 0.6625 ( 7330 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.6552 -6.6524 -6.2543 -6.2511 -6.1065 -6.0969
-6.0577 -6.0534 -1.2193 -1.1156 -1.0802 -1.0423 -0.9726 -0.8869
-0.8479 -0.7999 -0.4744 -0.2990 0.4159 0.5270 0.5589 0.5952
0.6315 0.7006 0.8260 0.8467 0.8891 0.9088 0.9739 1.0550
1.3702 1.4439 1.6086 1.6555 3.0763 3.1028 3.4558 3.4986
3.7092 3.7407 4.5175 4.5908 4.9563 5.0877 5.2468 5.3268
5.4192 5.4699 5.7696 5.8827 5.9132 5.9960 7.7657 7.8105
8.5243 8.5405 9.0100 9.1070 10.6781 10.7494 10.8864 10.9276
11.3898 11.5060
k = 0.5000 0.3535 0.6497 ( 7320 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.6557 -6.6529 -6.2600 -6.2569 -6.1032 -6.0936
-6.0563 -6.0519 -1.2259 -1.1209 -1.0794 -1.0430 -0.9752 -0.8890
-0.8503 -0.7992 -0.4698 -0.2881 0.4142 0.5277 0.5576 0.5945
0.6317 0.7032 0.8278 0.8472 0.8892 0.9115 0.9805 1.0662
1.3845 1.4584 1.6191 1.6664 3.0876 3.1151 3.4526 3.4966
3.7066 3.7397 4.4935 4.5649 4.9526 5.0849 5.2132 5.2929
5.4093 5.4615 5.7585 5.8750 5.8991 5.9879 7.7940 7.8403
8.5474 8.5639 9.0131 9.1151 10.6476 10.7147 10.8574 10.8998
11.4176 11.5015
k = 0.5000 0.3535 0.6497 ( 7320 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7161
-14.7093 -14.7093 -6.6557 -6.6529 -6.2600 -6.2569 -6.1032 -6.0936
-6.0563 -6.0519 -1.2259 -1.1209 -1.0794 -1.0430 -0.9752 -0.8890
-0.8503 -0.7992 -0.4698 -0.2881 0.4142 0.5277 0.5576 0.5945
0.6317 0.7032 0.8278 0.8472 0.8892 0.9115 0.9805 1.0662
1.3845 1.4584 1.6191 1.6664 3.0876 3.1151 3.4526 3.4966
3.7066 3.7397 4.4935 4.5649 4.9526 5.0849 5.2132 5.2929
5.4093 5.4615 5.7585 5.8750 5.8991 5.9879 7.7940 7.8403
8.5474 8.5639 9.0131 9.1151 10.6476 10.7147 10.8574 10.8998
11.4176 11.5015
k = 0.5000 0.3535 0.6273 ( 7326 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7160
-14.7093 -14.7093 -6.6574 -6.6545 -6.2705 -6.2674 -6.0968 -6.0871
-6.0533 -6.0488 -1.2376 -1.1325 -1.0771 -1.0430 -0.9787 -0.8924
-0.8546 -0.7983 -0.4621 -0.2705 0.4119 0.5278 0.5557 0.5943
0.6327 0.7087 0.8275 0.8500 0.8857 0.9177 0.9948 1.0851
1.4133 1.4868 1.6376 1.6848 3.0988 3.1317 3.4517 3.4964
3.7119 3.7474 4.4500 4.5176 4.9373 5.0608 5.1635 5.2403
5.3915 5.4479 5.7375 5.8572 5.8764 5.9720 7.8470 7.8949
8.5944 8.6099 9.0108 9.1195 10.5844 10.6480 10.7945 10.8492
11.4732 11.4899
k = 0.5000 0.3535 0.6049 ( 7334 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7160
-14.7093 -14.7093 -6.6595 -6.6564 -6.2817 -6.2787 -6.0897 -6.0800
-6.0498 -6.0452 -1.2493 -1.1456 -1.0740 -1.0425 -0.9813 -0.8951
-0.8590 -0.7980 -0.4549 -0.2545 0.4102 0.5273 0.5535 0.5952
0.6340 0.7153 0.8263 0.8527 0.8811 0.9220 1.0113 1.1037
1.4453 1.5167 1.6586 1.7042 3.1100 3.1495 3.4514 3.4953
3.7171 3.7546 4.4081 4.4712 4.9204 5.0240 5.1257 5.1917
5.3737 5.4339 5.7150 5.8371 5.8529 5.9545 7.9031 7.9522
8.6412 8.6551 9.0036 9.1172 10.5162 10.5763 10.7240 10.7871
11.4731 11.5319
k = 0.5000 0.3535 0.5825 ( 7328 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7619 -14.7618 -14.7161 -14.7160
-14.7093 -14.7093 -6.6620 -6.6588 -6.2936 -6.2906 -6.0819 -6.0722
-6.0458 -6.0411 -1.2609 -1.1595 -1.0706 -1.0415 -0.9831 -0.8971
-0.8633 -0.7982 -0.4484 -0.2405 0.4091 0.5263 0.5513 0.5974
0.6356 0.7225 0.8247 0.8550 0.8760 0.9249 1.0286 1.1211
1.4807 1.5480 1.6819 1.7246 3.1207 3.1683 3.4521 3.4934
3.7218 3.7609 4.3692 4.4270 4.9016 4.9766 5.0974 5.1503
5.3561 5.4195 5.6914 5.8138 5.8299 5.9356 7.9614 8.0114
8.6867 8.6986 8.9915 9.1077 10.4441 10.5010 10.6474 10.7154
11.4511 11.5874
k = 0.5000 0.3535 0.5601 ( 7334 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7619 -14.7617 -14.7161 -14.7160
-14.7093 -14.7093 -6.6649 -6.6617 -6.3061 -6.3029 -6.0737 -6.0640
-6.0411 -6.0363 -1.2724 -1.1738 -1.0669 -1.0401 -0.9844 -0.8985
-0.8677 -0.7988 -0.4430 -0.2286 0.4084 0.5249 0.5491 0.6008
0.6374 0.7300 0.8229 0.8567 0.8709 0.9267 1.0454 1.1369
1.5195 1.5803 1.7074 1.7457 3.1304 3.1876 3.4541 3.4909
3.7258 3.7660 4.3342 4.3861 4.8806 4.9254 5.0708 5.1195
5.3386 5.4049 5.6668 5.7878 5.8077 5.9157 8.0215 8.0719
8.7292 8.7402 8.9749 9.0911 10.3696 10.4233 10.5659 10.6367
11.4216 11.5691
k = 0.5000 0.3535 0.5377 ( 7326 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7619 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.6683 -6.6650 -6.3189 -6.3158 -6.0650 -6.0552
-6.0359 -6.0310 -1.2836 -1.1882 -1.0631 -1.0380 -0.9851 -0.8992
-0.8719 -0.7996 -0.4387 -0.2188 0.4081 0.5230 0.5472 0.6055
0.6393 0.7375 0.8209 0.8571 0.8666 0.9278 1.0611 1.1505
1.5618 1.6133 1.7342 1.7678 3.1382 3.2068 3.4579 3.4883
3.7285 3.7691 4.3040 4.3494 4.8575 4.8748 5.0434 5.0995
5.3214 5.3902 5.6416 5.7602 5.7857 5.8948 8.0825 8.1331
8.7658 8.7802 8.9547 9.0675 10.2940 10.3445 10.4809 10.5532
11.3833 11.5214
k = 0.5000 0.3535 0.5153 ( 7330 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7619 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.6722 -6.6689 -6.3321 -6.3289 -6.0559 -6.0461
-6.0300 -6.0250 -1.2944 -1.2025 -1.0591 -1.0355 -0.9855 -0.8995
-0.8761 -0.8007 -0.4357 -0.2111 0.4082 0.5208 0.5457 0.6112
0.6413 0.7448 0.8188 0.8547 0.8647 0.9285 1.0749 1.1616
1.6075 1.6463 1.7612 1.7922 3.1437 3.2251 3.4637 3.4864
3.7296 3.7701 4.2796 4.3181 4.8252 4.8347 5.0183 5.0863
5.3046 5.3756 5.6161 5.7320 5.7633 5.8732 8.1438 8.1943
8.7931 8.8180 8.9336 9.0377 10.2185 10.2655 10.3933 10.4669
11.3353 11.4663
k = 0.5000 0.3535 0.4929 ( 7318 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.6765 -6.6732 -6.3455 -6.3422 -6.0465 -6.0366
-6.0234 -6.0184 -1.3049 -1.2165 -1.0550 -1.0325 -0.9855 -0.8993
-0.8800 -0.8020 -0.4341 -0.2057 0.4087 0.5181 0.5447 0.6178
0.6435 0.7519 0.8167 0.8497 0.8650 0.9288 1.0867 1.1700
1.6564 1.6785 1.7856 1.8213 3.1463 3.2411 3.4710 3.4873
3.7288 3.7684 4.2613 4.2929 4.7817 4.8098 4.9976 5.0772
5.2883 5.3611 5.5904 5.7040 5.7404 5.8510 8.2048 8.2549
8.8057 8.8519 8.9173 9.0027 10.1441 10.1873 10.3043 10.3794
11.2777 11.4041
k = 0.5000 0.3535 0.4705 ( 7304 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.6813 -6.6780 -6.3591 -6.3557 -6.0368 -6.0269
-6.0163 -6.0112 -1.3148 -1.2301 -1.0507 -1.0291 -0.9852 -0.8987
-0.8837 -0.8035 -0.4338 -0.2024 0.4096 0.5152 0.5442 0.6250
0.6460 0.7584 0.8144 0.8439 0.8661 0.9288 1.0962 1.1756
1.7057 1.7111 1.8062 1.8567 3.1457 3.2533 3.4780 3.4941
3.7260 3.7640 4.2495 4.2745 4.7425 4.7868 4.9815 5.0711
5.2725 5.3468 5.5648 5.6764 5.7170 5.8284 8.2649 8.3140
8.7967 8.8786 8.9131 8.9655 10.0718 10.1105 10.2150 10.2921
11.2108 11.3350
k = 0.5000 0.3535 0.4481 ( 7322 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7617 -14.7161 -14.7160
-14.7094 -14.7093 -6.6864 -6.6832 -6.3726 -6.3692 -6.0269 -6.0170
-6.0085 -6.0034 -1.3242 -1.2434 -1.0463 -1.0253 -0.9846 -0.8978
-0.8870 -0.8051 -0.4348 -0.2013 0.4108 0.5121 0.5442 0.6321
0.6492 0.7644 0.8121 0.8378 0.8673 0.9287 1.1034 1.1784
1.7350 1.7629 1.8241 1.8975 3.1419 3.2601 3.4857 3.5072
3.7212 3.7571 4.2439 4.2632 4.7086 4.7668 4.9697 5.0675
5.2575 5.3329 5.5395 5.6497 5.6931 5.8053 8.3234 8.3710
8.7693 8.8830 8.9207 8.9390 10.0022 10.0359 10.1262 10.2063
11.1356 11.2595
k = 0.5000 0.3535 0.4257 ( 7322 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7093 -6.6920 -6.6888 -6.3860 -6.3826 -6.0169 -6.0070
-6.0002 -5.9953 -1.3330 -1.2561 -1.0418 -1.0211 -0.9835 -0.8970
-0.8898 -0.8067 -0.4371 -0.2023 0.4125 0.5089 0.5444 0.6382
0.6541 0.7695 0.8094 0.8319 0.8687 0.9284 1.1081 1.1786
1.7590 1.8148 1.8433 1.9426 3.1353 3.2606 3.4967 3.5239
3.7148 3.7480 4.2441 4.2588 4.6807 4.7508 4.9616 5.0662
5.2434 5.3193 5.5146 5.6241 5.6689 5.7820 8.3797 8.4248
8.7321 8.8490 8.9304 8.9412 9.9356 9.9640 10.0390 10.1233
11.0529 11.1780
k = 0.5000 0.3535 0.4033 ( 7310 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7093 -6.6978 -6.6947 -6.3992 -6.3958 -6.0067 -5.9971
-5.9914 -5.9867 -1.3412 -1.2683 -1.0371 -1.0166 -0.9822 -0.8969
-0.8911 -0.8085 -0.4406 -0.2054 0.4146 0.5059 0.5450 0.6422
0.6614 0.7738 0.8063 0.8267 0.8701 0.9279 1.1104 1.1763
1.7796 1.8425 1.8862 1.9909 3.1263 3.2548 3.5115 3.5427
3.7072 3.7374 4.2498 4.2611 4.6590 4.7396 4.9566 5.0674
5.2302 5.3062 5.4903 5.5999 5.6444 5.7584 8.4328 8.4740
8.6909 8.8014 8.9339 8.9522 9.8721 9.8953 9.9543 10.0442
10.9637 11.0909
k = 0.5000 0.3535 0.3809 ( 7320 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7094 -6.7039 -6.7008 -6.4122 -6.4089 -5.9964 -5.9871
-5.9822 -5.9778 -1.3488 -1.2799 -1.0324 -1.0119 -0.9804 -0.8983
-0.8904 -0.8103 -0.4452 -0.2104 0.4171 0.5030 0.5458 0.6446
0.6706 0.7769 0.8020 0.8230 0.8716 0.9273 1.1103 1.1719
1.7968 1.8540 1.9440 2.0416 3.1157 3.2441 3.5291 3.5622
3.6988 3.7260 4.2602 4.2697 4.6438 4.7337 4.9545 5.0708
5.2181 5.2936 5.4668 5.5773 5.6198 5.7347 8.4811 8.5144
8.6511 8.7519 8.9331 8.9590 9.8112 9.8301 9.8731 9.9703
10.8690 10.9990
k = 0.5000 0.3535 0.3585 ( 7328 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7618 -14.7616 -14.7161 -14.7160
-14.7094 -14.7094 -6.7102 -6.7072 -6.4248 -6.4216 -5.9862 -5.9773
-5.9727 -5.9688 -1.3558 -1.2910 -1.0277 -1.0071 -0.9781 -0.9002
-0.8887 -0.8121 -0.4506 -0.2173 0.4201 0.5005 0.5466 0.6460
0.6806 0.7789 0.7964 0.8213 0.8731 0.9267 1.1078 1.1656
1.8108 1.8617 2.0042 2.0938 3.1039 3.2297 3.5477 3.5814
3.6902 3.7147 4.2750 4.2842 4.6349 4.7331 4.9548 5.0764
5.2073 5.2816 5.4442 5.5562 5.5951 5.7109 8.5192 8.5341
8.6259 8.7080 8.9275 8.9598 9.7516 9.7685 9.7973 9.9025
10.7700 10.9029
k = 0.5000 0.3535 0.3361 ( 7328 PWs) bands (ev):
-15.7612 -15.7611 -15.7546 -15.7545 -14.7617 -14.7616 -14.7161 -14.7160
-14.7094 -14.7094 -6.7165 -6.7136 -6.4370 -6.4339 -5.9759 -5.9676
-5.9631 -5.9597 -1.3621 -1.3014 -1.0231 -1.0021 -0.9754 -0.9018
-0.8865 -0.8140 -0.4567 -0.2260 0.4235 0.4984 0.5476 0.6469
0.6910 0.7796 0.7896 0.8216 0.8746 0.9260 1.1029 1.1578
1.8220 1.8670 2.0647 2.1467 3.0918 3.2130 3.5656 3.5991
3.6816 3.7041 4.2936 4.3041 4.6322 4.7376 4.9574 5.0841
5.1978 5.2703 5.4228 5.5369 5.5705 5.6871 8.5077 8.5424
8.6303 8.6859 8.9172 8.9545 9.6918 9.7080 9.7315 9.8414
10.6676 10.8035
k = 0.5000 0.3535 0.3137 ( 7308 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7545 -14.7617 -14.7616 -14.7161 -14.7160
-14.7095 -14.7094 -6.7229 -6.7201 -6.4487 -6.4457 -5.9658 -5.9579
-5.9536 -5.9507 -1.3678 -1.3112 -1.0187 -0.9971 -0.9722 -0.9031
-0.8840 -0.8160 -0.4634 -0.2365 0.4274 0.4967 0.5486 0.6472
0.7014 0.7786 0.7831 0.8234 0.8762 0.9253 1.0958 1.1487
1.8305 1.8702 2.1249 2.1995 3.0798 3.1952 3.5813 3.6145
3.6735 3.6949 4.3160 4.3291 4.6353 4.7466 4.9618 5.0937
5.1897 5.2598 5.4026 5.5193 5.5462 5.6633 8.4660 8.5216
8.6521 8.6968 8.9029 8.9439 9.6310 9.6470 9.6787 9.7867
10.5630 10.7016
k = 0.5000 0.3535 0.2913 ( 7296 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7545 -14.7617 -14.7616 -14.7161 -14.7160
-14.7095 -14.7094 -6.7292 -6.7266 -6.4599 -6.4570 -5.9558 -5.9484
-5.9443 -5.9418 -1.3729 -1.3204 -1.0144 -0.9922 -0.9685 -0.9038
-0.8814 -0.8181 -0.4703 -0.2485 0.4318 0.4956 0.5496 0.6470
0.7113 0.7726 0.7810 0.8261 0.8778 0.9246 1.0867 1.1387
1.8366 1.8718 2.1841 2.2515 3.0684 3.1771 3.5939 3.6266
3.6664 3.6876 4.3417 4.3585 4.6438 4.7596 4.9680 5.1047
5.1830 5.2502 5.3838 5.5032 5.5227 5.6395 8.4190 8.4775
8.6812 8.7202 8.8858 8.9295 9.5699 9.5904 9.6338 9.7379
10.4574 10.5982
k = 0.5000 0.3535 0.2689 ( 7296 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7545 -14.7617 -14.7616 -14.7161 -14.7160
-14.7095 -14.7094 -6.7354 -6.7329 -6.4705 -6.4678 -5.9460 -5.9392
-5.9353 -5.9332 -1.3774 -1.3291 -1.0105 -0.9874 -0.9643 -0.9038
-0.8787 -0.8203 -0.4773 -0.2621 0.4367 0.4952 0.5505 0.6462
0.7202 0.7645 0.7813 0.8296 0.8793 0.9240 1.0757 1.1279
1.8407 1.8719 2.2417 2.3022 3.0581 3.1594 3.6025 3.6344
3.6612 3.6824 4.3706 4.3917 4.6568 4.7755 4.9757 5.1169
5.1776 5.2418 5.3666 5.4879 5.5007 5.6157 8.3711 8.4271
8.7083 8.7423 8.8681 8.9141 9.5116 9.5392 9.5935 9.6938
10.3520 10.4945
k = 0.5000 0.3535 0.2465 ( 7298 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7545 -14.7617 -14.7615 -14.7161 -14.7160
-14.7095 -14.7094 -6.7414 -6.7391 -6.4804 -6.4778 -5.9366 -5.9303
-5.9267 -5.9249 -1.3813 -1.3371 -1.0069 -0.9830 -0.9596 -0.9032
-0.8760 -0.8226 -0.4841 -0.2769 0.4419 0.4954 0.5513 0.6447
0.7272 0.7563 0.7833 0.8335 0.8808 0.9234 1.0633 1.1165
1.8429 1.8707 2.2970 2.3510 3.0492 3.1426 3.6072 3.6368
3.6591 3.6789 4.4019 4.4278 4.6737 4.7935 4.9849 5.1297
5.1735 5.2347 5.3512 5.4709 5.4830 5.5921 8.3241 8.3758
8.7281 8.7570 8.8538 8.9016 9.4579 9.4930 9.5563 9.6531
10.2480 10.3914
k = 0.5000 0.3535 0.2240 ( 7314 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7545 -14.7617 -14.7615 -14.7161 -14.7160
-14.7095 -14.7094 -6.7472 -6.7450 -6.4896 -6.4872 -5.9276 -5.9218
-5.9186 -5.9171 -1.3846 -1.3445 -1.0037 -0.9793 -0.9541 -0.9017
-0.8734 -0.8251 -0.4903 -0.2929 0.4476 0.4962 0.5519 0.6424
0.7317 0.7483 0.7876 0.8378 0.8822 0.9229 1.0498 1.1045
1.8438 1.8686 2.3497 2.3972 3.0419 3.1270 3.6087 3.6347
3.6595 3.6767 4.4351 4.4659 4.6938 4.8125 4.9954 5.1423
5.1708 5.2293 5.3376 5.4515 5.4706 5.5686 8.2788 8.3257
8.7356 8.7583 8.8500 8.8967 9.4098 9.4519 9.5214 9.6149
10.1468 10.2902
k = 0.5000 0.3535 0.2016 ( 7304 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7545 -14.7617 -14.7615 -14.7161 -14.7160
-14.7095 -14.7095 -6.7526 -6.7505 -6.4980 -6.4959 -5.9190 -5.9138
-5.9110 -5.9098 -1.3873 -1.3513 -1.0006 -0.9764 -0.9480 -0.8996
-0.8710 -0.8278 -0.4956 -0.3098 0.4536 0.4978 0.5523 0.6391
0.7336 0.7409 0.7943 0.8424 0.8835 0.9226 1.0357 1.0919
1.8435 1.8658 2.3990 2.4403 3.0364 3.1129 3.6080 3.6309
3.6599 3.6748 4.4692 4.5047 4.7163 4.8316 5.0070 5.1524
5.1706 5.2258 5.3261 5.4324 5.4608 5.5454 8.2360 8.2780
8.7298 8.7453 8.8596 8.9009 9.3676 9.4161 9.4881 9.5781
10.0497 10.1919
k = 0.5000 0.3535 0.1792 ( 7274 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7615 -14.7161 -14.7160
-14.7095 -14.7095 -6.7575 -6.7557 -6.5056 -6.5037 -5.9111 -5.9064
-5.9041 -5.9030 -1.3895 -1.3576 -0.9979 -0.9745 -0.9411 -0.8968
-0.8688 -0.8309 -0.4998 -0.3274 0.4599 0.5000 0.5526 0.6348
0.7331 0.7347 0.8029 0.8474 0.8847 0.9223 1.0214 1.0790
1.8425 1.8623 2.4447 2.4800 3.0326 3.1003 3.6060 3.6267
3.6593 3.6728 4.5034 4.5429 4.7406 4.8501 5.0195 5.1560
5.1760 5.2242 5.3168 5.4151 5.4524 5.5225 8.1961 8.2334
8.7148 8.7244 8.8768 8.9118 9.3316 9.3853 9.4561 9.5419
9.9582 10.0977
k = 0.5000 0.3535 0.1568 ( 7286 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7615 -14.7161 -14.7160
-14.7095 -14.7095 -6.7621 -6.7604 -6.5124 -6.5107 -5.9038 -5.8997
-5.8978 -5.8969 -1.3912 -1.3633 -0.9952 -0.9734 -0.9335 -0.8936
-0.8671 -0.8343 -0.5025 -0.3456 0.4665 0.5028 0.5526 0.6294
0.7284 0.7323 0.8127 0.8525 0.8857 0.9221 1.0074 1.0658
1.8410 1.8585 2.4861 2.5156 3.0306 3.0894 3.6036 3.6224
3.6579 3.6703 4.5367 4.5788 4.7660 4.8674 5.0325 5.1543
5.1849 5.2243 5.3102 5.4005 5.4449 5.5000 8.1599 8.1924
8.6954 8.7016 8.8965 8.9261 9.3018 9.3591 9.4255 9.5059
9.8741 10.0088
k = 0.5000 0.3535 0.1344 ( 7286 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7615 -14.7161 -14.7160
-14.7095 -14.7095 -6.7661 -6.7646 -6.5184 -6.5169 -5.8973 -5.8937
-5.8922 -5.8915 -1.3923 -1.3685 -0.9928 -0.9730 -0.9255 -0.8901
-0.8658 -0.8382 -0.5034 -0.3639 0.4731 0.5059 0.5526 0.6229
0.7238 0.7300 0.8231 0.8579 0.8865 0.9217 0.9943 1.0525
1.8393 1.8546 2.5229 2.5470 3.0302 3.0800 3.6011 3.6182
3.6561 3.6674 4.5682 4.6112 4.7919 4.8834 5.0454 5.1508
5.1932 5.2251 5.3067 5.3892 5.4380 5.4781 8.1276 8.1555
8.6746 8.6800 8.9170 8.9419 9.2779 9.3366 9.3968 9.4699
9.7990 9.9262
k = 0.5000 0.3535 0.1120 ( 7278 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7615 -14.7161 -14.7160
-14.7095 -14.7095 -6.7695 -6.7683 -6.5234 -6.5222 -5.8916 -5.8886
-5.8874 -5.8869 -1.3930 -1.3732 -0.9904 -0.9733 -0.9171 -0.8864
-0.8651 -0.8426 -0.5023 -0.3823 0.4798 0.5091 0.5529 0.6155
0.7204 0.7275 0.8338 0.8634 0.8871 0.9209 0.9829 1.0392
1.8377 1.8507 2.5547 2.5737 3.0311 3.0721 3.5989 3.6140
3.6541 3.6643 4.5971 4.6386 4.8176 4.8977 5.0578 5.1466
5.1997 5.2255 5.3070 5.3817 5.4311 5.4572 8.0999 8.1231
8.6548 8.6606 8.9372 8.9583 9.2595 9.3166 9.3713 9.4344
9.7347 9.8511
k = 0.5000 0.3535 0.0896 ( 7258 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7615 -14.7160 -14.7160
-14.7095 -14.7095 -6.7723 -6.7714 -6.5276 -6.5266 -5.8867 -5.8843
-5.8834 -5.8831 -1.3931 -1.3773 -0.9881 -0.9740 -0.9085 -0.8827
-0.8650 -0.8476 -0.4989 -0.4003 0.4864 0.5118 0.5538 0.6072
0.7180 0.7249 0.8444 0.8687 0.8873 0.9188 0.9742 1.0261
1.8364 1.8469 2.5812 2.5957 3.0331 3.0655 3.5972 3.6099
3.6524 3.6611 4.6228 4.6602 4.8422 4.9099 5.0693 5.1417
5.2041 5.2247 5.3114 5.3780 5.4238 5.4378 8.0770 8.0957
8.6378 8.6437 8.9569 8.9746 9.2457 9.2972 9.3507 9.4005
9.6830 9.7844
k = 0.5000 0.3535 0.0672 ( 7232 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7615 -14.7160 -14.7160
-14.7095 -14.7095 -6.7746 -6.7738 -6.5308 -6.5300 -5.8828 -5.8809
-5.8803 -5.8802 -1.3928 -1.3810 -0.9859 -0.9751 -0.8998 -0.8792
-0.8656 -0.8533 -0.4933 -0.4177 0.4927 0.5134 0.5560 0.5985
0.7166 0.7224 0.8548 0.8738 0.8873 0.9147 0.9697 1.0134
1.8355 1.8435 2.6023 2.6126 3.0359 3.0598 3.5960 3.6060
3.6512 3.6582 4.6447 4.6754 4.8649 4.9187 5.0802 5.1361
5.2067 5.2224 5.3197 5.3772 5.4141 5.4222 8.0593 8.0734
8.6244 8.6298 8.9755 8.9899 9.2356 9.2777 9.3359 9.3705
9.6454 9.7272
k = 0.5000 0.3535 0.0448 ( 7230 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7615 -14.7160 -14.7160
-14.7095 -14.7095 -6.7761 -6.7756 -6.5330 -6.5325 -5.8799 -5.8785
-5.8782 -5.8780 -1.3920 -1.3841 -0.9838 -0.9765 -0.8912 -0.8758
-0.8668 -0.8595 -0.4854 -0.4342 0.4987 0.5134 0.5599 0.5896
0.7160 0.7202 0.8648 0.8781 0.8869 0.9081 0.9697 1.0014
1.8352 1.8406 2.6178 2.6244 3.0392 3.0550 3.5957 3.6025
3.6507 3.6555 4.6624 4.6842 4.8851 4.9229 5.0910 5.1295
5.2083 5.2191 5.3310 5.3772 5.4014 5.4127 8.0472 8.0566
8.6151 8.6192 8.9920 9.0026 9.2288 9.2587 9.3264 9.3472
9.6228 9.6805
k = 0.5000 0.3535 0.0224 ( 7230 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7160 -14.7160
-14.7095 -14.7095 -6.7770 -6.7768 -6.5343 -6.5341 -5.8780 -5.8771
-5.8769 -5.8767 -1.3907 -1.3868 -0.9818 -0.9781 -0.8829 -0.8727
-0.8692 -0.8659 -0.4754 -0.4495 0.5040 0.5117 0.5657 0.5809
0.7162 0.7184 0.8736 0.8809 0.8874 0.9001 0.9739 0.9905
1.8355 1.8382 2.6277 2.6309 3.0428 3.0506 3.5961 3.5996
3.6510 3.6534 4.6755 4.6869 4.9018 4.9215 5.1018 5.1216
5.2100 5.2155 5.3442 5.3712 5.3957 5.4053 8.0407 8.0455
8.6099 8.6122 9.0046 9.0105 9.2264 9.2421 9.3223 9.3319
9.6156 9.6456
k = 0.5000 0.3535 0.0000 ( 7200 PWs) bands (ev):
-15.7611 -15.7611 -15.7546 -15.7546 -14.7616 -14.7616 -14.7160 -14.7160
-14.7095 -14.7095 -6.7772 -6.7772 -6.5347 -6.5347 -5.8770 -5.8770
-5.8764 -5.8764 -1.3890 -1.3890 -0.9799 -0.9799 -0.8750 -0.8750
-0.8698 -0.8698 -0.4633 -0.4633 0.5084 0.5084 0.5728 0.5728
0.7170 0.7170 0.8795 0.8795 0.8922 0.8922 0.9811 0.9811
1.8365 1.8365 2.6320 2.6320 3.0466 3.0466 3.5974 3.5974
3.6518 3.6518 4.6838 4.6838 4.9143 4.9143 5.1122 5.1122
5.2123 5.2123 5.3583 5.3583 5.3990 5.3990 8.0402 8.0402
8.6090 8.6090 9.0113 9.0113 9.2307 9.2307 9.3239 9.3239
9.6235 9.6235
k = 0.0000 0.0000 0.8662 ( 7358 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7546 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6502 -6.6502 -6.2101 -6.2101 -6.1237 -6.1237
-6.0655 -6.0655 -1.1362 -1.1362 -1.0473 -1.0473 -0.8760 -0.8760
-0.8309 -0.8309 -0.4747 -0.4747 0.4704 0.4704 0.5870 0.5870
0.6882 0.6882 0.7787 0.7787 0.8735 0.8735 0.9661 0.9661
1.2789 1.2789 1.5619 1.5619 3.0312 3.0312 3.4733 3.4733
3.6863 3.6863 4.8154 4.8154 5.0812 5.0812 5.5155 5.5155
5.6740 5.6740 5.8893 5.8893 6.0131 6.0131 7.5462 7.5462
8.2681 8.2681 8.9564 8.9564 10.8875 10.8875 11.0396 11.0396
11.2603 11.2603
k = 0.0179 0.0126 0.8662 ( 7328 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7546 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6506 -6.6498 -6.2102 -6.2101 -6.1241 -6.1232
-6.0656 -6.0655 -1.1387 -1.1335 -1.0545 -1.0397 -0.8772 -0.8751
-0.8354 -0.8266 -0.4865 -0.4625 0.4695 0.4713 0.5853 0.5891
0.6852 0.6906 0.7750 0.7815 0.8714 0.8766 0.9634 0.9699
1.2766 1.2831 1.5570 1.5622 3.0171 3.0300 3.4776 3.4776
3.6921 3.7008 4.8142 4.8151 5.0740 5.0765 5.5111 5.5180
5.6638 5.6860 5.8791 5.8949 6.0056 6.0189 7.5509 7.5512
8.2707 8.2721 8.9522 8.9524 10.8614 10.9084 11.0158 11.0668
11.2611 11.2633
k = 0.0357 0.0252 0.8662 ( 7312 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7546 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6509 -6.6494 -6.2102 -6.2100 -6.1245 -6.1228
-6.0657 -6.0655 -1.1410 -1.1308 -1.0615 -1.0320 -0.8786 -0.8746
-0.8400 -0.8225 -0.4977 -0.4500 0.4685 0.4723 0.5843 0.5917
0.6817 0.6922 0.7708 0.7834 0.8702 0.8806 0.9617 0.9749
1.2764 1.2891 1.5475 1.5581 2.9897 3.0141 3.4902 3.4905
3.7171 3.7336 4.8114 4.8133 5.0554 5.0600 5.5043 5.5190
5.6558 5.6987 5.8648 5.8953 5.9967 6.0239 7.5652 7.5657
8.2797 8.2825 8.9398 8.9402 10.8329 10.9172 11.0025 11.0948
11.2655 11.2699
k = 0.0536 0.0379 0.8662 ( 7312 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7546 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6513 -6.6490 -6.2102 -6.2100 -6.1250 -6.1225
-6.0657 -6.0655 -1.1431 -1.1280 -1.0681 -1.0242 -0.8801 -0.8744
-0.8447 -0.8186 -0.5082 -0.4375 0.4676 0.4732 0.5838 0.5946
0.6779 0.6928 0.7665 0.7843 0.8697 0.8854 0.9609 0.9812
1.2780 1.2969 1.5337 1.5501 2.9528 2.9867 3.5111 3.5122
3.7580 3.7806 4.8067 4.8096 5.0267 5.0325 5.4951 5.5188
5.6501 5.7108 5.8467 5.8896 5.9871 6.0291 7.5886 7.5893
8.2946 8.2987 8.9195 8.9202 10.8029 10.9064 11.0074 11.1226
11.2738 11.2800
k = 0.0714 0.0505 0.8662 ( 7316 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7546 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6516 -6.6487 -6.2102 -6.2099 -6.1254 -6.1221
-6.0658 -6.0655 -1.1450 -1.1251 -1.0744 -1.0163 -0.8818 -0.8748
-0.8494 -0.8151 -0.5179 -0.4250 0.4666 0.4742 0.5840 0.5978
0.6738 0.6923 0.7625 0.7843 0.8696 0.8906 0.9612 0.9890
1.2812 1.3059 1.5161 1.5389 2.9102 2.9515 3.5400 3.5422
3.8104 3.8378 4.7996 4.8038 4.9896 4.9957 5.4833 5.5176
5.6462 5.7207 5.8249 5.8784 5.9781 6.0350 7.6206 7.6214
8.3144 8.3199 8.8918 8.8928 10.7720 10.8826 11.0242 11.1495
11.2859 11.2935
k = 0.0893 0.0631 0.8662 ( 7316 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6519 -6.6483 -6.2101 -6.2098 -6.1258 -6.1218
-6.0659 -6.0655 -1.1467 -1.1222 -1.0802 -1.0083 -0.8834 -0.8757
-0.8540 -0.8118 -0.5267 -0.4129 0.4656 0.4752 0.5848 0.6012
0.6696 0.6906 0.7592 0.7837 0.8697 0.8958 0.9623 0.9986
1.2857 1.3158 1.4954 1.5254 2.8648 2.9124 3.5761 3.5797
3.8706 3.9022 4.7888 4.7949 4.9467 4.9515 5.4690 5.5153
5.6434 5.7262 5.8015 5.8627 5.9709 6.0417 7.6604 7.6610
8.3382 8.3449 8.8572 8.8586 10.7407 10.8541 11.0448 11.1751
11.3020 11.3101
k = 0.1071 0.0757 0.8662 ( 7312 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7619 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6522 -6.6480 -6.2101 -6.2097 -6.1262 -6.1215
-6.0660 -6.0656 -1.1482 -1.1194 -1.0856 -1.0004 -0.8850 -0.8771
-0.8585 -0.8089 -0.5345 -0.4012 0.4647 0.4761 0.5862 0.6046
0.6653 0.6876 0.7567 0.7827 0.8700 0.9006 0.9643 1.0102
1.2910 1.3259 1.4722 1.5106 2.8191 2.8720 3.6186 3.6239
3.9356 3.9711 4.7720 4.7817 4.9017 4.9027 5.4520 5.5117
5.6411 5.7222 5.7823 5.8447 5.9657 6.0486 7.7069 7.7072
8.3646 8.3723 8.8165 8.8184 10.7097 10.8245 11.0661 11.1991
11.3220 11.3296
k = 0.1250 0.0884 0.8662 ( 7312 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6525 -6.6477 -6.2100 -6.2096 -6.1266 -6.1212
-6.0661 -6.0656 -1.1494 -1.1167 -1.0905 -0.9927 -0.8865 -0.8791
-0.8627 -0.8063 -0.5414 -0.3903 0.4638 0.4771 0.5882 0.6081
0.6610 0.6836 0.7550 0.7814 0.8702 0.9049 0.9670 1.0237
1.2962 1.3354 1.4478 1.4957 2.7750 2.8325 3.6663 3.6736
4.0032 4.0428 4.7448 4.7609 4.8539 4.8604 5.4324 5.5062
5.6388 5.7039 5.7742 5.8262 5.9626 6.0554 7.7589 7.7591
8.3923 8.4004 8.7705 8.7732 10.6796 10.7952 11.0870 11.2211
11.3459 11.3516
k = 0.1429 0.1010 0.8662 ( 7314 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6527 -6.6474 -6.2100 -6.2095 -6.1269 -6.1210
-6.0662 -6.0657 -1.1505 -1.1142 -1.0948 -0.9852 -0.8879 -0.8815
-0.8666 -0.8041 -0.5473 -0.3804 0.4630 0.4780 0.5907 0.6115
0.6569 0.6787 0.7542 0.7800 0.8704 0.9085 0.9702 1.0391
1.3004 1.3434 1.4235 1.4822 2.7338 2.7955 3.7180 3.7275
4.0712 4.1155 4.7034 4.7277 4.8112 4.8277 5.4106 5.4982
5.6364 5.6776 5.7734 5.8090 5.9611 6.0616 7.8148 7.8156
8.4197 8.4276 8.7202 8.7245 10.6510 10.7675 11.1068 11.2411
11.3731 11.3754
k = 0.1607 0.1136 0.8662 ( 7304 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6529 -6.6471 -6.2099 -6.2094 -6.1272 -6.1208
-6.0663 -6.0657 -1.1513 -1.1119 -1.0986 -0.9782 -0.8892 -0.8842
-0.8701 -0.8022 -0.5522 -0.3716 0.4622 0.4788 0.5936 0.6147
0.6530 0.6735 0.7538 0.7787 0.8706 0.9114 0.9738 1.0562
1.3019 1.3488 1.4012 1.4714 2.6967 2.7623 3.7720 3.7841
4.1377 4.1875 4.6503 4.6812 4.7769 4.8028 5.3876 5.4870
5.6338 5.6516 5.7747 5.7943 5.9607 6.0671 7.8734 7.8751
8.4453 8.4512 8.6673 8.6744 10.6249 10.7421 11.1251 11.2590
11.4003 11.4030
k = 0.1786 0.1262 0.8662 ( 7308 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6531 -6.6469 -6.2099 -6.2093 -6.1274 -6.1206
-6.0664 -6.0658 -1.1519 -1.1099 -1.1018 -0.9717 -0.8902 -0.8870
-0.8732 -0.8006 -0.5562 -0.3641 0.4616 0.4796 0.5967 0.6177
0.6494 0.6681 0.7538 0.7775 0.8707 0.9137 0.9775 1.0743
1.2982 1.3511 1.3840 1.4642 2.6649 2.7337 3.8264 3.8415
4.2005 4.2567 4.5917 4.6293 4.7458 4.7818 5.3649 5.4728
5.6302 5.6313 5.7763 5.7826 5.9609 6.0717 7.9328 7.9358
8.4673 8.4674 8.6137 8.6271 10.6021 10.7199 11.1411 11.2747
11.4251 11.4344
k = 0.1964 0.1389 0.8662 ( 7304 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6532 -6.6468 -6.2099 -6.2093 -6.1276 -6.1205
-6.0665 -6.0658 -1.1524 -1.1083 -1.1043 -0.9661 -0.8911 -0.8897
-0.8757 -0.7994 -0.5592 -0.3580 0.4610 0.4802 0.5997 0.6204
0.6462 0.6631 0.7540 0.7765 0.8708 0.9153 0.9809 1.0928
1.2879 1.3506 1.3737 1.4606 2.6390 2.7107 3.8782 3.8969
4.2573 4.3198 4.5331 4.5812 4.7130 4.7627 5.3444 5.4572
5.6149 5.6291 5.7739 5.7775 5.9614 6.0753 7.9905 7.9950
8.4687 8.4824 8.5643 8.5911 10.5832 10.7017 11.1545 11.2878
11.4480 11.4658
k = 0.2143 0.1515 0.8662 ( 7308 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6533 -6.6466 -6.2098 -6.2092 -6.1278 -6.1204
-6.0665 -6.0658 -1.1527 -1.1071 -1.1061 -0.9617 -0.8920 -0.8917
-0.8776 -0.7986 -0.5613 -0.3537 0.4607 0.4807 0.6024 0.6227
0.6435 0.6589 0.7542 0.7758 0.8709 0.9165 0.9836 1.1101
1.2737 1.3485 1.3694 1.4595 2.6200 2.6938 3.9230 3.9457
4.3049 4.3695 4.4796 4.5480 4.6772 4.7457 5.3280 5.4431
5.6051 5.6273 5.7679 5.7784 5.9619 6.0778 8.0420 8.0488
8.4497 8.4795 8.5331 8.5748 10.5692 10.6882 11.1646 11.2977
11.4669 11.4936
k = 0.2321 0.1641 0.8662 ( 7308 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6533 -6.6466 -6.2098 -6.2092 -6.1279 -6.1204
-6.0665 -6.0659 -1.1529 -1.1072 -1.1064 -0.9588 -0.8936 -0.8921
-0.8788 -0.7980 -0.5626 -0.3510 0.4604 0.4809 0.6043 0.6243
0.6417 0.6561 0.7544 0.7753 0.8709 0.9171 0.9854 1.1234
1.2610 1.3465 1.3681 1.4596 2.6084 2.6834 3.9547 3.9810
4.3399 4.3949 4.4379 4.5431 4.6410 4.7334 5.3175 5.4332
5.5997 5.6262 5.7645 5.7790 5.9622 6.0794 8.0801 8.0894
8.4235 8.4566 8.5286 8.5719 10.5605 10.6798 11.1709 11.3040
11.4794 11.5121
k = 0.2500 0.1767 0.8662 ( 7292 PWs) bands (ev):
-15.7612 -15.7612 -15.7546 -15.7545 -14.7620 -14.7619 -14.7161 -14.7161
-14.7093 -14.7093 -6.6533 -6.6465 -6.2098 -6.2092 -6.1279 -6.1203
-6.0666 -6.0659 -1.1530 -1.1076 -1.1061 -0.9578 -0.8942 -0.8922
-0.8792 -0.7979 -0.5630 -0.3501 0.4603 0.4811 0.6051 0.6249
0.6410 0.6551 0.7544 0.7752 0.8709 0.9173 0.9860 1.1286
1.2558 1.3457 1.3679 1.4597 2.6045 2.6799 3.9663 3.9942
4.3552 4.3997 4.4196 4.5526 4.6204 4.7287 5.3139 5.4297
5.5980 5.6258 5.7634 5.7791 5.9623 6.0799 8.0948 8.1053
8.4113 8.4448 8.5294 8.5720 10.5576 10.6770 11.1731 11.3062
11.4837 11.5179
Writing output data file SnxHgSe2x2.save
init_run : 3.82s CPU 12.42s WALL ( 1 calls)
electrons : 1942.89s CPU 1960.32s WALL ( 1 calls)
Called by init_run:
wfcinit : 0.00s CPU 0.00s WALL ( 1 calls)
potinit : 0.39s CPU 1.56s WALL ( 1 calls)
Called by electrons:
c_bands : 1942.87s CPU 1960.07s WALL ( 1 calls)
v_of_rho : 0.14s CPU 1.00s WALL ( 1 calls)
v_h : 0.01s CPU 0.01s WALL ( 1 calls)
v_xc : 0.12s CPU 0.65s WALL ( 1 calls)
newd : 0.72s CPU 0.81s WALL ( 1 calls)
Called by c_bands:
init_us_2 : 0.02s CPU 0.10s WALL ( 268 calls)
cegterg : 1859.03s CPU 1873.39s WALL ( 634 calls)
Called by sum_band:
Called by *egterg:
h_psi : 1022.01s CPU 1032.56s WALL ( 10779 calls)
s_psi : 50.12s CPU 50.44s WALL ( 10779 calls)
g_psi : 1.87s CPU 2.01s WALL ( 9877 calls)
cdiaghg : 547.17s CPU 545.09s WALL ( 10145 calls)
cegterg:over : 149.60s CPU 147.76s WALL ( 9877 calls)
cegterg:upda : 48.87s CPU 51.40s WALL ( 9877 calls)
cegterg:last : 41.91s CPU 42.72s WALL ( 2242 calls)
Called by h_psi:
h_psi:vloc : 915.41s CPU 923.31s WALL ( 10779 calls)
h_psi:vnl : 105.66s CPU 107.33s WALL ( 10779 calls)
add_vuspsi : 38.62s CPU 42.03s WALL ( 10779 calls)
General routines
calbec : 66.98s CPU 65.22s WALL ( 10779 calls)
fft : 0.54s CPU 1.33s WALL ( 19 calls)
ffts : 0.01s CPU 0.01s WALL ( 4 calls)
fftw : 850.42s CPU 854.95s WALL ( 1951016 calls)
interpolate : 0.09s CPU 0.10s WALL ( 4 calls)
davcio : 0.03s CPU 2.35s WALL ( 536 calls)
Parallel routines
fft_scatter : 506.31s CPU 502.29s WALL ( 1951039 calls)
PWSCF : 33m47.27s CPU 36m44.14s WALL
This run was terminated on: 4: 0:57 28Oct2015
=------------------------------------------------------------------------------=
JOB DONE.
=------------------------------------------------------------------------------=