Input 29-pcm_chlorine_anion.02-td_prop-n60.inp
Commits >
Commit 69bdc22e524ab1df7701119670aff9b913714e90 >
Run foss_mpi_debug_autotools: [foss2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| M-solvent int. energy @ t=0 | -3.216045980687151e+00 | -3.216045980686861e+00 | 3.190000000000000e-13 | -2.904343432419410e-13 | PASS |
| M-solvent int. energy @ t=5*dt | -3.216045980698752e+00 | -3.215406787112854e+00 | 1.000000000000000e+00 | -6.391935858984787e-04 | PASS |