Match Born charge O ZZ w=-0.2
Commits >
Commit 4e4258e65e606bf002e3af34a10a78b31d6cc70d >
Run foss_cmake: [foss2022a-serial, foss-full] >
Input 02-h2o_pol_lr.03_h2o_dyn_pol_cmplx.inp
Value | Reference | Precision | Status |
-1.772797000000000e+00 | -1.772797000000000e+00 | 8.860000000000000e-06 | PASS |
Command: LINEFIELD(em_resp/freq_-0.2000/born_charges, 7, 3)