Match Exchange energy
Commits >
Commit 968a3ff7080ffa1f89f08d37efc7416527769dec >
Run foss_min_autotools: [foss2022a-serial] >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
-9.198639578000000e+01 | -9.198639570000000e+01 | 4.600000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Exchange =', 3)