Match Partial charge 1
Commits >
Commit f4bc596bdcf3afff33b833944576bfd5457df1bc >
Run foss-serial-min: [foss2023b-serial] >
Input 24-o2-spin.01-gs.inp
Value | Reference | Precision | Status |
6.000000000000000e+00 | 6.000000000000000e+00 | 1.000000000000000e-01 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 2)