Match Born charge O XX w=0.1
Commits >
Commit e5fcdd4b6e483a88fb99eafb58d1df80750fbe8c >
Run foss-2022a_opt >
Input 02-h2o_pol_lr.02_h2o_dyn_pol.inp
Value | Reference | Precision | Status |
-1.968670000000000e-01 | -1.968670000000000e-01 | 9.840000000000001e-06 | PASS |
Command: LINEFIELD(em_resp/freq_0.1000/born_charges, 3, 1)