Match Total energy
Commits >
Commit 7368b0b20aad13e0ecfc3e36ba5b1a9f5c3d54b1 >
Run cmake_foss_2022a_min_mpi >
Input 08-vdw_ts.01-gs.inp
Value | Reference | Precision | Status |
-2.874878069000000e+01 | -2.874878069000000e+01 | 1.440000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)