Match electrons-solvent int. energy
Commits >
Commit 6dda27ed08cd9fd2b2f861e6109ead2bd6d3cd56 >
Run intel_mpi_omp_autotools: [intel2022a-mpi] >
Input 29-pcm_chlorine_anion.04-ground_state-n240.inp
Value | Reference | Precision | Status |
-2.704767199000000e+01 | -2.704767199000000e+01 | 1.350000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'E_e-solvent =', 3)