Input 32-tdpcm_methane.02-td_prop_neq.inp
Commits >
Commit f22bb0bcca4b53614d336c5e83de089ff68b1baa >
Run foss-cmake-zen4: [foss2023a-serial, ci-foss-full]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| M-solvent int. energy @ t=0 | -1.501569625137147e-02 | -1.495587719231000e-02 | 1.000000000000000e-04 | -5.981905906146667e-05 | PASS |
| M-solvent int. energy @ t=21*dt | -1.508530737255718e-02 | -1.502584992053000e-02 | 1.000000000000000e-04 | -5.945745202718365e-05 | PASS |