Match Born charge diff w=-0.2
Commits >
Commit 45adf9b0e5ec0c590d65885bc40efffc0d377767 >
Run foss_mpi_debug_autotools: [foss2023a-mpi] >
Input 02-h2o_pol_lr.03_h2o_dyn_pol_cmplx.inp
| Value | Reference | Precision | Status |
| -1.415050000000000e-01 | -1.415050000000000e-01 | 7.080000000000000e-06 | PASS |
Command: GREPFIELD(em_resp/freq_-0.2000/born_charges, "Discrepancy", 3, 5)