Match Initial energy
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run foss_ppc_autotools: [foss2022a-serial] >
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)