Match Exchange energy
Commits >
Commit c461bdde143a1ab201b7896fffa943f7e4c29d0f >
Run foss-opt-full: [foss2023a-serial] >
Input 28-carbon_big_box.01-ground_state.inp
Value | Reference | Precision | Status |
-3.067813600000000e-01 | -3.067869100000000e-01 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'Exchange =', 3)