Match Partial charge 1
Commits >
Commit 917d830e9234ff154f8a96d6b6c157a89a03a450 >
Run foss-cmake: [foss2022a-mpi, foss-min-mpi] >
Input 20-eigensolver.06-rmmdiis-noscalapack.inp
Value | Reference | Precision | Status |
4.157000000000000e+00 | 4.157000000000000e+00 | 2.080000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 2)