Match Partial charge 4
Commits >
Commit c18e6529b073b7f96582e125ea28d09e3ac5067c >
Run spack_intel-2022a_serial_omp >
Input 33-cg.03-cg_direction.inp
| Value | Reference | Precision | Status |
| 9.600000000000000e-01 | 9.550000000000000e-01 | 4.780000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 5)