Match Partial charge 5
Commits >
Commit 584f61e8603689505e758f366f49c21c2e481def >
Run intel_mpi_autotools: [intel2023a-mpi] >
Input 16-scfinlcao_std.01-gs.inp
Value | Reference | Precision | Status |
7.031000000000000e+00 | 7.032000000000000e+00 | 3.520000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 6)