Input 29-pcm_chlorine_anion.02-td_prop-n60.inp
Commits >
Commit 2b78a76b7053787dce5c406550a4bb5b7bd1d2d3 >
Run foss_cuda_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| M-solvent int. energy @ t=0 | -3.215406787815676e+00 | -3.215406787815846e+00 | 2.120000000000000e-13 | 1.696420781627239e-13 | PASS |
| M-solvent int. energy @ t=5*dt | -3.215406787112903e+00 | -3.215406787112854e+00 | 2.000000000000000e+00 | -4.929390229335695e-14 | PASS |