Match M-solvent int. energy @ t=5*dt
Commits >
Commit 968a3ff7080ffa1f89f08d37efc7416527769dec >
Run foss_cmake: [foss2022a-mpi, foss-min-mpi] >
Input 29-pcm_chlorine_anion.02-td_prop-n60.inp
Value | Reference | Precision | Status |
-3.215406787112903e+00 | -3.215406787112854e+00 | 2.000000000000000e+00 | PASS |
Command: GREPFIELD(td.general/energy, ' 5', 12)