Match Partial charge 3
Commits >
Commit 4e4258e65e606bf002e3af34a10a78b31d6cc70d >
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, 4)