Match Initial energy
Commits >
Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e >
Run GCI_foss_opt_autotools: [foss2023a-serial] >
Input 23-td_qedft_breit_pxlda_adiabatic.01-gs.inp
Value | Reference | Precision | Status |
-4.966259600000000e-01 | -4.966259600000000e-01 | 3.000000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)