input alternatives and further options for XAS


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
 
temperature300 # [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
wmaxg1 1239.30 # [eV] end of linear ramp
 
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

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