Input 23-td_qedft_breit_pxlda_adiabatic.02-td.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Energy [step 0] |
-1.351259613523185e+01 |
-1.351259613523188e+01 |
2.520000000000000e-13 |
3.197442310920451e-14 |
PASS |
| Energy [step 52] |
-1.351221767670767e+01 |
-1.351221767670754e+01 |
4.630000000000000e-13 |
-1.278976924368180e-13 |
PASS |
| Multipoles [step 0] |
3.377291543611277e-16 |
0.000000000000000e+00 |
1.000000000000000e-15 |
3.377291543611277e-16 |
PASS |
| Multipoles [step 52] |
-3.817238054786243e-03 |
-3.817238054773396e-03 |
6.510000000000000e-14 |
-1.284736206308423e-14 |
PASS |