Match Total energy
Commits >
Commit 6e9e1a4536d8fe2a292bd24d601ed608cb4be1e6 >
Run foss-mpi-opt-full: [foss2023a-mpi] >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
-3.184216953300000e+02 | -3.184216894050000e+02 | 7.430000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)