- show()
-
Displays the energy level diagram window for a molecule.
- unit([unit])
-
Sets or returns the energy unit for the energy level diagram. unit has to
be one of the integer constants
HARTREE, KJ/MOL, EV, or
1/CM defined in the energylevel module.
- resolution([resolution])
-
Sets or returns the resolution for the energy level diagram. resolution has
to be a double greater than zero.
- mode([mode])
-
Sets or returns the mode for the energy level diagram. mode has to be one
of the integer constants
ENERGY_LEVELS or DENSITY_OF_STATES defined
in the energylevel module.
- selectMO(mo1, [mo2])
-
Selects one or two molecular orbitals. mo1 and mo2 have to be
integers between 0 and the number of molecular orbitals.
- deselect()
-
Deselects molecular orbitals which have been selected with a call to
selectMO.
- saveDrawing(format, filename)
-
Saves the energy level diagram to file. format has to be one of the integer
constants
TIFF, PNG, HPGL, or POSTSCRIPT defined in the viewmol
module. filename has to be a string containing the name of the file the drawing
is saved to.
The energy level diagram window can be closed by deleting the energylevel
object.
Jörg-Rüdiger Hill Fri Oct 31 14:19:21 CET 2003