Match Born charge 1 XX w=0.1
Commits >
Commit 57f8ca8d342504024fed98c8f4356f69f5870627 >
Run intel-serial: [intel2023a-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)