Match molecule-solvent int. energy
Commits >
Commit 3f3300a09a325083399ad405019c399609c6d1c2 >
Run foss-serial-full: [foss2023a-serial] >
Input 32-tdpcm_methane.01-ground_state.inp
Value | Reference | Precision | Status |
-1.501570000000000e-02 | -1.501570000000000e-02 | 7.510000000000000e-16 | PASS |
Command: GREPFIELD(static/info, 'E_M-solvent =', 3)