Match Born charge O YY w=0.1
Commits >
Commit fb3b67f6830f0e047754886f078a46875acffbf8 >
Run foss-serial-debug: [foss2023a-serial] >
Input 02-h2o_pol_lr.03_h2o_dyn_pol_cmplx.inp
Value | Reference | Precision | Status |
-4.029470000000000e-01 | -4.029470000000000e-01 | 2.010000000000000e-05 | PASS |
Command: LINEFIELD(em_resp/freq_0.1000/born_charges, 6, 2)