Match Partial charge 45
Commits >
Commit e2663e21d2b19b776c1ae6497ca3d74f14dbf310 >
Run foss-2022a_ppc >
Input 10-vdw_d3_dna.01-gs_novdw.inp
| Value | Reference | Precision | Status |
| 1.007000000000000e+00 | 1.007000000000000e+00 | 5.030000000000000e-03 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 46)