Match M-solvent int. energy @ t=0
Commits >
Commit adb0a770f40b5954f8a07de2fe2e63c9718fe526 >
Run intel-2022b_impi >
Input 29-pcm_chlorine_anion.02-td_prop-n60.inp
Value | Reference | Precision | Status |
-3.215406787815942e+00 | -3.215406787815954e+00 | 2.790000000000000e-13 | PASS |
Command: GREPFIELD(td.general/energy, ' 0', 12)