Match Partial charge 4
Commits >
Commit d48128afc066bfe2b1bb5979f9ee62249e46c834 >
Run spack_foss-2023a_serial_omp >
Input 20-eigensolver.05-rmmdiis.inp
| Value | Reference | Precision | Status |
| 9.610000000000000e-01 | 9.610000000000000e-01 | 4.810000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 5)