Match Partial charge 2
Commits >
Commit c7ac96946c926bee5c46ca4221093c1f60753f5a >
Run spack_intel-2023a_serial_omp >
Input 30-local_multipoles.01-gs.inp
Value | Reference | Precision | Status |
9.320000000000001e-01 | 9.320000000000001e-01 | 4.660000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 3)