Match Initial energy
Commits >
Commit e0b7240ece6c1278a2610f2d337090ca4d2c526d >
Run cmake_foss_2022a_min_mpi >
Input 24-adsic_freeze_orbitals.01-gs.inp
Value | Reference | Precision | Status |
-1.977413220000000e+00 | -1.977413220000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)