Match Born charge O XX w=0.1
Commits >
Commit ad9fcbdd35c8d08e16e213263c476bba0afb770b >
Run spack_foss-2023a_serial_min >
Input 02-h2o_pol_lr.02_h2o_dyn_pol.inp
Value | Reference | Precision | Status |
-1.968670000000000e-01 | -1.968670000000000e-01 | 9.840000000000001e-06 | PASS |
Command: LINEFIELD(em_resp/freq_0.1000/born_charges, 3, 1)