Input 32-tdpcm_methane.03-td_prop_eom.inp
Commits >
Commit 9c5e1a9ae4a97d24a493b8c6c0caa96edfef5d41 >
Run foss-cmake-zen4: [foss2023a-serial, foss-full]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| M-solvent int. energy @ t=0 | -1.501569625163732e-02 | -1.495587625573000e-02 | 1.000000000000000e-04 | -5.981999590732277e-05 | PASS |
| M-solvent int. energy @ t=21*dt | -1.508533060265576e-02 | -1.502587164251000e-02 | 1.000000000000000e-04 | -5.945896014576332e-05 | PASS |