#
# input file for test08
#
# Photodetachment from F2-
#
 LMax  60     # maximum l to be used for wave functions
 EMax 100.
 PrintFlag 0   # no extra printing
 FegeEng 5.   # Energy correction used in the fege potential (9.89 eV from CRC)
 LMaxK   12     # Maximum l in the K matirx
 OrbOccInit
  2 2 2 2 4 4 2 1
 OrbOcc        # occupation of the orbital groups of target
  2 2 2 2 4 4 2 0
 SpinDeg 2         # Spin degeneracy of the total scattering state (=1 singlet)
 TargSym 'SG'      # Symmetry of the target state
 TargSpinDeg 1     # Target spin degeneracy
 InitSym 'SU'      # Initial state symmetry
 InitSpinDeg 2     # Initial state spin degeneracy
  IPot 3.1    # IPot, ionization potential, Koopmans

 Convert '$pe/tests/test08.molden' 'molden2006'
 GetBlms
#
ScatEng 1. 40.
 ExpOrb

 ScatSym     'SG' # Scattering symmetry of total final state
 ScatContSym 'SG' # Scattering symmetry of continuum electron

GenFormPhIon
DipoleOp
GetPot
FileName 'MatrixElements' 'test08SG.dat' 'REWIND'
PhIon
GetCro
CalcInt 'DipoleOp' 1 'PlaneWv' 12
FileName 'MatrixElements' 'test08PWSG.dat' 'REWIND'
PhIonPlaneWv
GetCro

 ScatSym     'PG' # Scattering symmetry of total final state
 ScatContSym 'PG' # Scattering symmetry of continuum electron

GenFormPhIon
DipoleOp
GetPot
FileName 'MatrixElements' 'test08PG.dat' 'REWIND'
PhIon
GetCro
CalcInt 'DipoleOp' 1 'PlaneWv' 12
FileName 'MatrixElements' 'test08PWPG.dat' 'REWIND'
PhIonPlaneWv
GetCro
GetCro 'test08SG.dat' 'test08PG.dat'
GetCro 'test08PWSG.dat' 'test08PWPG.dat'