Match Partial charge 10
Commits >
Commit d89ed1adec8f63937926022ba961c15ddb98b66b >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] >
Input 10-vdw_d3_dna.01-gs_novdw.inp
Value | Reference | Precision | Status |
4.905000000000000e+00 | 4.904000000000000e+00 | 2.450000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 11)