Match Partial charge 1
Commits >
Commit 42d5c2c12b8376ac01df1778205b77ce6ca96480 >
Run spack_foss-2023a_mpi_opt >
Input 20-eigensolver.05-rmmdiis.inp
| Value | Reference | Precision | Status |
| 4.157000000000000e+00 | 4.157000000000000e+00 | 2.080000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 2)