Match Hartree energy
Commits >
Commit d48128afc066bfe2b1bb5979f9ee62249e46c834 >
Run cmake_foss_2022a_full_mpi >
Input 09-vdw_ts_sc.01-gs.inp
Value | Reference | Precision | Status |
5.016538032000000e+01 | 5.016538032000000e+01 | 2.510000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)