Match M-solvent int. energy @ t=0
Commits >
Commit ea6affb390844fd1d159151b43e705a091215c1a >
Run cmake_foss_2022a_min_mpi >
Input 29-pcm_chlorine_anion.02-td_prop-n60.inp
Value | Reference | Precision | Status |
-3.215406787815894e+00 | -3.215406787815954e+00 | 2.790000000000000e-13 | PASS |
Command: GREPFIELD(td.general/energy, ' 0', 12)