Match Born charge 1 XX w=0.1
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_ppc_autotools: [foss2022a-serial] >
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", 1, 2)