Match nuclei-solvent int. energy
Commits >
Commit fe1e2fbde8e2f64defe360a8f89092b8d1773e8d >
Run intel-serial: [intel2023a-serial] >
Input 29-pcm_chlorine_anion.04-ground_state-n240.inp
Value | Reference | Precision | Status |
2.383975967000000e+01 | 2.383975967000000e+01 | 1.190000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'E_n-solvent =', 3)