Match Partial charge 20

Commits > Commit 57f8ca8d342504024fed98c8f4356f69f5870627 > Run foss-mpi-min: [foss2022a-mpi] > Input 10-vdw_d3_dna.01-gs_novdw.inp
Value Reference Precision Status
4.145000000000000e+00 4.146000000000000e+00 2.070000000000000e-02 PASS
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 21)
Compare to other runs.