Match M-solvent int. energy @ t=0
Commits >
Commit e5fcdd4b6e483a88fb99eafb58d1df80750fbe8c >
Run spack_foss-2022a_serial_min >
Input 32-tdpcm_methane.02-td_prop_neq.inp
Value | Reference | Precision | Status |
-1.501578001378937e-02 | -1.495587719231000e-02 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(td.general/energy, ' 0', 12)