To run the program simply type
where input is the name of the file containing the data to be plotted and N is the number of the mode along which the cut is to be made. If the arguments are not given, the user is prompted for the file and mode no.
lmplot input N
The input file can either be the .lmi file from a fit, or the .dat database created by LMTRANS. In the former case
the ab initio points along the cut together with curves from the fit are plotted. In the latter case
lmplot input.lmi N
only the ab initio points along the cut are plotted. If no type is given, the program assumes it is looking for a .lmi file.
lmplot input.dat N
Options | ||
---|---|---|
Keyword | Description | |
-dipole a s s1 | Plots the dipole matrix element indexed by the component a (x, y, or z) of the electric field and states s and s1 | |
-polar a a1 s s1 | Plots the polarisability tensor element indexed by the components a and a1 (x, y, or z) of the electric field and states s and s1 | |
-adiab | Plots the adiabatic dipole or polarisability surface | |
-xrange XI XF | The Xrange of the plot is XI to XF | |
-yrange YI YF | The Yrange of the plot is YI to YF |