Match Partial charge 1
Commits >
Commit 2cbd57b62c972cb2ebea8f328fb20b62d521e0ac >
Run spack_foss-2022a_mpi >
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)