Input 29-pcm_chlorine_anion.02-td_prop-n60.inp
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run intel_mpi_autotools: [intel2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| M-solvent int. energy @ t=0 | -3.215406787815773e+00 | -3.215406787815954e+00 | 2.790000000000000e-13 | 1.811883976188255e-13 | PASS |
| M-solvent int. energy @ t=5*dt | -3.215406787112855e+00 | -3.215406787112854e+00 | 2.000000000000000e+00 | -8.881784197001252e-16 | PASS |