Match Partial charge 1
Commits >
Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a >
Run spack_foss-2023a_mpi_min >
Input 30-local_multipoles.01-gs.inp
| Value | Reference | Precision | Status |
| 4.274000000000000e+00 | 4.274000000000000e+00 | 2.140000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 2)