| new | XAS_AV |
# alternative for unpolarized XAS beam, angular polarization average |
| beam_in | 0.866 0 0.5 |
# define direction of incoming Xray beam |
| |
| new | XAS_totAV |
# alternative for random molecule orientation, polarization average |
| |
| new | XMLD |
# XMLD XLD measurement with 2 different linear polarizations |
| polar_in2 |
0 1 0 |
# 2nd polarization direction |
| |
| new | XMCD |
# XMCD measurement with circular polarizations |
| beam_in |
0.5 0 0.866 |
# define direction of incoming Xray beam |
| bfield_dir |
0.5 0 0.866 |
# define direction of B field |
| bfield | 10.0 |
# [T] magnitude of B field |
| |
| temperature | 300 |
# [K] thermal occupation of low lying states |
| |
| deltag1 | 0.2 |
# [eV] change of core hole lifetime over linear ramp |
| wming1 | 1232.02 |
# [eV] begin of linear ramp |
| wdifg1 | 7.28 |
# [eV] end of ramp wr begin, better suited for optimizations |
| wmaxg1 | 1239.30 |
# [eV] end of linear ramp, can be problematic as variable parameter |
| |
| scaler_so_val | 0.915 |
# use a different scaling for valence S-O coupling |
| |
| scaler_coulomb_vv | 0.895 |
# use a different scaling for valence-valence electron interaction |
| scaler_coulomb_cv | 0.90 |
# use a different scaling for core-valence electron interaction |
| |
| spect_emin | 774. |
# to define spectral range for AMOE_mult use |
| spect_emax | 797. |
# to define spectral range for AMOE_mult use |
| spect_numpts | 576 |
# to define spectral energy steps for AMOE_mult use |
| |
| GSanalyze | | # analyze the subspace of the ground state J multiplet
|
| QNprint | 15 | # print expectation values for quantum numbers of the lowest states
|