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...Charmol is capable of making pictures containing:
- from small- to large-size molecules
- more molecules together (different settings possible)
- orbitals using molden and fchk files (GTO functions up to 'h' angular momentum supported)
- surfaces using gaussian cube files (also color-mapped surfaces according to potential)
- schematic representation of vibrations using arrows
- user-defined arrows representing vectorial properties
- measuring gauges
- combinations of these features (more orbitals together, orbitals and arrows together etc.)
Charmol allows for fine tuning of the final molecular design.
...It's features include:
-1D, 2D, and 3D structures that are periodic in 1 or 2 dimensions
-Materials that are anisotropic in permittivity and conductivity
-Obliquely incident sources
-Built-in vectorial (i.e. full polarization) near-to-far-field transformation
See these publications for full details on the algorithm:
http://www.ece.ncsu.edu/oleg/files-wiki/6/62/SPIE_12_Miskiewicz_wolfsim3D.pdf
http://www.ece.ncsu.edu/oleg/files-wiki/1/13/OptExpress07_OH.pdf