Match Partial charge 1
Commits >
Commit 332f9cd714e196a805e42e2741bfb36d81a9f700 >
Run foss_cmake: [foss2022a-serial, foss-min] >
Input 30-local_multipoles.01-gs.inp
Value | Reference | Precision | Status |
4.258000000000000e+00 | 4.274000000000000e+00 | 2.140000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 2)