MopacView

DESCRIPTION

This module reads the MOPAC plot file and generates a lattice. It is fundamentally an implementation of the MOPAC DENSITY program.

INPUTS

WIDGETS

Port: File Name
Type: Text
Input filename of MOPAC file13

Port: Planes
Type: Slider
Number of planes in each direction

Port: Key Words
Type: Text
Keywords for the DENSITY program

OUTPUTS

Port: Volume
Type: Lattice
Constraints: 3-D
Constraints: 1-vector
Constraints: float
Constraints: uniform
Output lattice of data from eigenvalues stored in plot file

KNOWN PROBLEMS

Because the MOPAC plot file is written in a non-portable binary format, it is not (in general) possible to use this module to read files that have been generated by MOPAC running on other platforms.

SEE ALSO


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© The Numerical Algorithms Group Ltd, Oxford UK. 2000