Match Partial charge 15
Commits >
Commit 3c5618978387ff506850febf67c434621a2adfa2 >
Run intel_mpi_omp_autotools: [intel2022a-mpi] >
Input 10-vdw_d3_dna.01-gs_novdw.inp
| Value | Reference | Precision | Status |
| 4.131000000000000e+00 | 4.130000000000000e+00 | 2.070000000000000e-01 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 16)