Match M-solvent int. energy @ t=0
Commits >
Commit 332f9cd714e196a805e42e2741bfb36d81a9f700 >
Run foss-opt-full: [foss2023a-serial] >
Input 32-tdpcm_methane.03-td_prop_eom.inp
Value | Reference | Precision | Status |
-1.501569625161315e-02 | -1.495587625573000e-02 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(td.general/energy, ' 0', 12)