Match Born charge O ZZ w=0.1
Commits >
Commit 3186a8a51be7ad5a27ccff6e8e2901df0a16a559 >
Run GCI_foss_valgrind_autotools: [foss2023a-serial] >
Input 02-h2o_pol_lr.03_h2o_dyn_pol_cmplx.inp
Value | Reference | Precision | Status |
1.328250000000000e-01 | 1.328250000000000e-01 | 6.640000000000000e-06 | PASS |
Command: LINEFIELD(em_resp/freq_0.1000/born_charges, 7, 3)