Match Total energy
Commits >
Commit 3f59639a2c09960e9ce8b923e2789a20396f5ecf >
Run cmake_foss_2022a_full_mpi >
Input 23-go-na2.02-simplex.inp
Value | Reference | Precision | Status |
-4.174826300000000e-01 | -4.174826000000000e-01 | 2.090000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)