Match Total energy
Commits >
Commit dbbd967b788cdda4a2df74a46ac2e5066a09d99b >
Run foss-ppc: [foss2022a-serial] >
Input 15-calcium_psp8_sic.01-gs.inp
Value | Reference | Precision | Status |
-8.706605400000000e-01 | -8.706602500000000e-01 | 3.000000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)