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2*                       EXAMPLE SCRIPT FOR jmol                                *
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4
5It can be used to plot potentials or charge_densities as .cube files
6
7First convert the output file 'potential.dat' or 'charge_density.dat' into
8a cube file using the program makecube (source makecube.f90)
9
10Then you need specific jmol commands
11
12Example:
13
14script colormap128.jmol
15load "structure.xyz"
16isosurface pl1 fullplane plane {-1.2 0.8 0 0} color range all colorscheme 'user' 'potential.cube'
17
18Edit with appropriate changes.
19NOTE: jmol cannot read .gen files. The structure should be converted to xyz
20
21Refer to the jmol documentation
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23