Match Ion-ion energy
Commits >
Commit 32ddd3547162625b90bad3fe3e58ca7314bc5873 >
Run intel-2022a >
Input 17-scfinlcao_alt.01-gs.inp
Value | Reference | Precision | Status |
1.601151136450000e+03 | 1.601151136450000e+03 | 8.010000000000000e-08 | PASS |
Command: GREPFIELD(static/info, 'Ion-ion =', 3)