Match nuclei-solvent int. energy
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run autotools_foss_mpi_omp: [foss2023a-mpi] >
Input 29-pcm_chlorine_anion.04-ground_state-n240.inp
Value | Reference | Precision | Status |
2.383747560000000e+01 | 2.383747560000000e+01 | 1.190000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'E_n-solvent =', 3)