Match molecule-solvent int. energy
Commits >
Commit c9606f298ccf4e57d14167459d26815f7508aa3e >
Run foss_mpi_omp_autotools: [foss2023a-mpi] >
Input 29-pcm_chlorine_anion.03-ground_state-n60-poisson.inp
Value | Reference | Precision | Status |
-3.215658700000000e+00 | -3.215658700000000e+00 | 1.610000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'E_M-solvent =', 3)