Match Hyperpolarizability w=0.1 Im
Commits >
Commit adc9f2ea8065b70b337db7e35c2a67771b9e5a60 >
Run intel_mpi_autotools: [intel2023a-mpi] >
Input 02-h2o_pol_lr.03_h2o_dyn_pol_cmplx.inp
Value | Reference | Precision | Status |
-3.995408100000000e-01 | -3.995405000000000e-01 | 2.000000000000000e-06 | PASS |
Command: GREPFIELD(em_resp/freq_0.1000/beta, 'beta // y', 5)