Match electrons-solvent int. energy
Commits >
Commit 6fea4ae0129736a1dfe4fc8183ca68b9f7403b45 >
Run cuda-serial: [foss2022a-cuda-mpi] >
Input 29-pcm_chlorine_anion.03-ground_state-n60-poisson.inp
Value | Reference | Precision | Status |
-2.707880024000000e+01 | -2.707880024000000e+01 | 1.350000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'E_e-solvent =', 3)