Match Born charge O ZZ w=0.0
Commits >
Commit 119356330ffc33ec037b7259f31bc868121af1f1 >
Run spack_foss-2022a_ppc >
Input 06-h2o_pol_lr.03_emresp.inp
| Value | Reference | Precision | Status |
| -6.243400000000000e-01 | -6.243400000000000e-01 | 3.120000000000000e-04 | PASS |
Command: LINEFIELD(em_resp/freq_0.0000/born_charges, 7, 3)