Match M-solvent int. energy @ t=0
Commits >
Commit 9972eae3cc35bad71f44bb929051f5e204f853a2 >
Run intel_omp_autotools: [intel2023a-serial] >
Input 32-tdpcm_methane.03-td_prop_eom.inp
Value | Reference | Precision | Status |
-1.501569625168566e-02 | -1.495587625573000e-02 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(td.general/energy, ' 0', 12)