Match Born charge O YY w=0.1
Commits >
Commit 8520a932a983b5c1584256e5aef0dad9a7dbc2f2 >
Run eb_foss-2022a >
Input 02-h2o_pol_lr.03_h2o_dyn_pol_cmplx.inp
Value | Reference | Precision | Status |
-4.078800000000000e-01 | -4.078800000000000e-01 | 2.040000000000000e-04 | PASS |
Command: LINEFIELD(em_resp/freq_0.1000/born_charges, 6, 2)