Input 29-pcm_chlorine_anion.02-td_prop-n60.inp
Commits >
Commit 0a2b0bf36feedeffb58bf70ad5882092a0f43b8a >
Run foss_cmake: [foss2022a-mpi, foss-full-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| M-solvent int. energy @ t=0 | -3.216045980687031e+00 | -3.216045980686861e+00 | 3.190000000000000e-13 | -1.696420781627239e-13 | PASS |
| M-solvent int. energy @ t=5*dt | -3.216045980698704e+00 | -3.215406787112854e+00 | 1.000000000000000e+00 | -6.391935858500730e-04 | PASS |