Match Born charge O YY w=0.0
Commits >
Commit eff5280d65f29f89ecacf7a6e9c2d06020a47460 >
Run foss_cmake_ceph: [foss2022a-mpi, foss-min-mpi] >
Input 06-h2o_pol_lr.03_emresp.inp
Value | Reference | Precision | Status |
-3.422950000000000e-01 | -3.422950000000000e-01 | 1.710000000000000e-05 | PASS |
Command: LINEFIELD(em_resp/freq_0.0000/born_charges, 6, 2)