Match Born charge 1 ZZ w=0.1
Commits >
Commit ff858744384f796bd1ad65ff45f26dd2d219c42c >
Run foss_mpi_debug_autotools: [foss2023a-mpi] >
Input 04-silicon.03-emresp.inp
Value | Reference | Precision | Status |
-2.812991000000000e+00 | -2.812991000000000e+00 | 1.410000000000000e-05 | PASS |
Command: GREPFIELD(em_resp/freq_0.1000/born_charges, "Index: 1", 3, 4)