MFDCS
MFDCS
Energy-1 Energy-2 ...
This command computes to elastic differential scattering cross section in the molecular frame without including
any correction for dipole scattering.
If any Energy-n are present, then the MFDCS is computed at these energies.
Otherwise the MFDCS is computed at all energies for which T-matrices for all symmetries have been computed.
The T-matrices are obtained from the internal data structure for the T-matrix elements
created using the
MatrixElementsCollect
and MatrixElementsCombine
commands.
If the internal data structure is not present, then the T-matrix elements are taken from
the scratch file used for the output from Scat
.
If the PlotData
file has been defined then the computed DCS are also written to that file.
The command FileName is used to select what is written out and where it is put.
MFDCSGeom
is where geometry information is written for single orientation calculations
MFDCS
is where the differential cross sections are written in .dat format
PlotData
.