Match Total energy
Commits >
Commit a207e10cd726e9ee7bae9ea565d18a80e5fdcb20 >
Run intel_mpi_autotools: [intel2023a-mpi] >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
-3.245067411400000e+02 | -3.245067404600000e+02 | 3.870000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)