Match Born charge O XX w=-0.2
Commits >
Commit ab5faecb27d88076e64ba8608dc3fc5641398a04 >
Run foss_valgrind_autotools: [foss2023a-serial] >
Input 02-h2o_pol_lr.03_h2o_dyn_pol_cmplx.inp
Value | Reference | Precision | Status |
-3.508420000000000e-01 | -3.508420000000000e-01 | 1.750000000000000e-05 | PASS |
Command: LINEFIELD(em_resp/freq_-0.2000/born_charges, 5, 1)