Match Born charge 1 XZ w=0.1
Commits >
Commit f72050fe95608e153e1887ef05d1ad42dc082fde >
Run intel-serial: [intel2023a-serial] >
Input 04-silicon.03-emresp.inp
Value | Reference | Precision | Status |
0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(em_resp/freq_0.1000/born_charges, "Index: 1", 1, 4)