Match Partial charge 1
Commits >
Commit ff858744384f796bd1ad65ff45f26dd2d219c42c >
Run foss_mpi_omp_autotools: [foss2023a-mpi] >
Input 16-scfinlcao_std.01-gs.inp
Value | Reference | Precision | Status |
3.966000000000000e+00 | 3.973000000000000e+00 | 1.990000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 2)