Match External energy
Commits >
Commit dbbd967b788cdda4a2df74a46ac2e5066a09d99b >
Run foss-serial-debug: [foss2023a-serial] >
Input 28-carbon_big_box.01-ground_state.inp
Value | Reference | Precision | Status |
-1.099734898000000e+01 | -1.099738571000000e+01 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'External =', 3)