Match Initial energy
Commits >
Commit c461bdde143a1ab201b7896fffa943f7e4c29d0f >
Run cuda-serial: [foss2022a-cuda-mpi] >
Input 23-td_qedft_breit_pxlda_adiabatic.01-gs.inp
Value | Reference | Precision | Status |
-4.965787900000000e-01 | -4.965787900000000e-01 | 2.480000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)