Match Born charge O XX w=0.1
Commits >
Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 >
Run eb_foss-2022b_libxc6 >
Input 06-h2o_pol_lr.03_emresp.inp
Value | Reference | Precision | Status |
-5.311500000000000e-01 | -5.311500000000000e-01 | 2.660000000000000e-04 | PASS |
Command: LINEFIELD(em_resp/freq_0.1000/born_charges, 5, 1)