Match Partial charge 4
Commits >
Commit bb161c2d0107cec853e686df3a469ebc444968d7 >
Run foss_cmake_mpi_min: [foss2022a-mpi] >
Input 17-scfinlcao_alt.01-gs.inp
Value | Reference | Precision | Status |
7.024000000000000e+00 | 7.024000000000000e+00 | 3.510000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 5)