Match Ion-ion energy
Commits >
Commit b7dcc99023940be2b83de00317ffa33e598f3f55 >
Run foss_min_autotools: [foss2023b-serial] >
Input 31-acetylene_b3lyp.01-gs.inp
Value | Reference | Precision | Status |
1.315759358000000e+01 | 1.315759358000000e+01 | 6.579999999999999e-08 | PASS |
Command: GREPFIELD(static/info, 'Ion-ion =', 3)