Match M-solvent int. energy @ t=21*dt
Commits >
Commit 8520a932a983b5c1584256e5aef0dad9a7dbc2f2 >
Run cmake_foss_2022a_full_mpi >
Input 32-tdpcm_methane.02-td_prop_neq.inp
Value | Reference | Precision | Status |
-1.508539158028088e-02 | -1.502584992053000e-02 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(td.general/energy, ' 21', 12)