Match M-solvent int. energy @ t=5*dt
Commits >
Commit 6dda27ed08cd9fd2b2f861e6109ead2bd6d3cd56 >
Run foss_cuda_autotools: [foss2022a-cuda-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)