Match Partial charge 1
Commits >
Commit 701869cc1eb5c6c77a64efba9e1ed1058e4204f9 >
Run foss-serial-debug: [foss2023a-serial] >
Input 20-eigensolver.05-rmmdiis.inp
Value | Reference | Precision | Status |
4.157000000000000e+00 | 4.157000000000000e+00 | 2.080000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 2)