Input 03-sodium_chain.02-unocc.inp
Matches
Name |
Value |
Reference |
Precision |
Difference |
Status |
Bands n=1,k=1 |
-3.647611000000000e+00 |
-3.647611000000000e+00 |
1.820000000000000e-05 |
0.000000000000000e+00 |
PASS |
Bands n=1,k=2 |
-3.551626000000000e+00 |
-3.551627000000000e+00 |
1.780000000000000e-05 |
9.999999996956888e-07 |
PASS |
Bands n=1,k=3 |
-3.264557000000000e+00 |
-3.264557000000000e+00 |
1.630000000000000e-05 |
0.000000000000000e+00 |
PASS |
Bands n=1,k=4 |
-2.789111000000000e+00 |
-2.789111000000000e+00 |
1.390000000000000e-05 |
0.000000000000000e+00 |
PASS |
Bands n=1,k=5 |
-2.130396000000000e+00 |
-2.130397000000000e+00 |
1.070000000000000e-05 |
9.999999996956888e-07 |
PASS |
Bands n=1,k=6 |
-1.367358000000000e+00 |
-1.367359000000000e+00 |
6.840000000000000e-06 |
9.999999999177334e-07 |
PASS |
Bands n=2,k=1 |
-1.236399000000000e+00 |
-1.236400000000000e+00 |
6.180000000000000e-04 |
9.999999999177334e-07 |
PASS |
Bands n=2,k=2 |
-1.144853000000000e+00 |
-1.144853000000000e+00 |
5.720000000000000e-06 |
0.000000000000000e+00 |
PASS |
Bands n=2,k=3 |
-8.703330000000000e-01 |
-8.703340000000001e-01 |
4.350000000000000e-05 |
1.000000000028756e-06 |
PASS |
Bands n=2,k=4 |
-4.134630000000000e-01 |
-4.134630000000000e-01 |
2.070000000000000e-05 |
0.000000000000000e+00 |
PASS |
Bands n=2,k=5 |
-2.806530000000000e-01 |
-2.806530000000000e-01 |
1.400000000000000e-05 |
0.000000000000000e+00 |
PASS |
Bands n=2,k=6 |
-1.210152000000000e+00 |
-1.210152000000000e+00 |
6.050000000000000e-06 |
0.000000000000000e+00 |
PASS |