Input 29-pcm_chlorine_anion.02-td_prop-n60.inp
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda]
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 | -3.215406787112903e+00 | -3.215406787112854e+00 | 2.000000000000000e+00 | -4.929390229335695e-14 | PASS |