Match Energy [step 0]
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run foss_cuda_autotools: [foss2022a-cuda-mpi] >
Input 23-td_qedft_breit_pxlda_adiabatic.02-td.inp
Value | Reference | Precision | Status |
-1.351259613523207e+01 | -1.351259613523188e+01 | 2.520000000000000e-13 | PASS |
Command: LINEFIELD(td.general/energy, -53, 3)