Match Total energy
Commits >
Commit efc44ae2259e56922145db535c825ce53e4127cb >
Run foss_mpi_autotools: [foss2022a-mpi] >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
-3.245067411800000e+02 | -3.245067404600000e+02 | 3.870000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)