Match Born charge O XX w=-0.2
Commits >
Commit d6f4833c99197407842d58e82c91c418d3d73b88 >
Run spack_foss-2023a_mpi_omp >
Input 02-h2o_pol_lr.03_h2o_dyn_pol_cmplx.inp
Value | Reference | Precision | Status |
-3.665740000000000e-01 | -3.665740000000000e-01 | 1.830000000000000e-05 | PASS |
Command: LINEFIELD(em_resp/freq_-0.2000/born_charges, 5, 1)