Input 15-bandstructure.02-unocc.inp
Matches
Name |
Value |
Reference |
Precision |
Difference |
Status |
Red. coord. k1 |
0.000000000000000e+00 |
0.000000000000000e+00 |
1.000000000000000e-04 |
0.000000000000000e+00 |
PASS |
Band structure k1x |
5.000000000000000e-01 |
5.000000000000000e-01 |
5.000000000000000e-03 |
0.000000000000000e+00 |
PASS |
Band structure k1y |
0.000000000000000e+00 |
0.000000000000000e+00 |
1.000000000000000e-04 |
0.000000000000000e+00 |
PASS |
Band structure k1z |
0.000000000000000e+00 |
0.000000000000000e+00 |
1.000000000000000e-04 |
0.000000000000000e+00 |
PASS |
Band structure E1(k1) |
-1.994362300000000e-01 |
-1.994362300000000e-01 |
9.970000000000000e-08 |
0.000000000000000e+00 |
PASS |
Band structure E2(k1) |
-1.044774200000000e-01 |
-1.044774200000000e-01 |
5.220000000000000e-08 |
0.000000000000000e+00 |
PASS |
Band structure E3(k1) |
1.102773700000000e-01 |
1.102773700000000e-01 |
5.510000000000000e-08 |
0.000000000000000e+00 |
PASS |
Red. coord. k3 |
1.320064500000000e-01 |
1.320064500000000e-01 |
6.600000000000000e-08 |
0.000000000000000e+00 |
PASS |
Band structure k3x |
2.500000000000000e-01 |
2.500000000000000e-01 |
2.500000000000000e-03 |
0.000000000000000e+00 |
PASS |
Band structure k3y |
0.000000000000000e+00 |
0.000000000000000e+00 |
1.000000000000000e-04 |
0.000000000000000e+00 |
PASS |
Band structure k3z |
0.000000000000000e+00 |
0.000000000000000e+00 |
1.000000000000000e-04 |
0.000000000000000e+00 |
PASS |
Band structure E7(k3) |
2.829629700000000e-01 |
2.829629200000000e-01 |
1.410000000000000e-07 |
4.999999997368221e-08 |
PASS |
Band structure E8(k3) |
4.089613100000000e-01 |
4.089613100000000e-01 |
2.040000000000000e-07 |
0.000000000000000e+00 |
PASS |
Band structure E9(k3) |
4.185885600000000e-01 |
4.185886500000000e-01 |
2.090000000000000e-07 |
-9.000000000813912e-08 |
PASS |
Red. coord. k7 |
3.402268600000000e-01 |
3.402268600000000e-01 |
1.700000000000000e-07 |
0.000000000000000e+00 |
PASS |
Band structure k7x |
0.000000000000000e+00 |
0.000000000000000e+00 |
1.000000000000000e-04 |
0.000000000000000e+00 |
PASS |
Band structure k7y |
1.250000000000000e-01 |
1.250000000000000e-01 |
6.250000000000000e-03 |
0.000000000000000e+00 |
PASS |
Band structure k7z |
1.250000000000000e-01 |
1.250000000000000e-01 |
6.250000000000000e-03 |
0.000000000000000e+00 |
PASS |
Band structure E7(k7) |
2.907609400000000e-01 |
2.907608900000000e-01 |
1.450000000000000e-07 |
5.000000002919336e-08 |
PASS |
Band structure E8(k7) |
3.186701700000000e-01 |
3.186701700000000e-01 |
1.590000000000000e-14 |
0.000000000000000e+00 |
PASS |
Band structure E9(k7) |
3.931644300000000e-01 |
3.931642600000000e-01 |
1.970000000000000e-07 |
1.700000000215418e-07 |
PASS |