XCrySDen¶

Description¶

XCrySDen is a crystalline and molecular structure visualization program aiming at display of isosurfaces and contours, which can be superimposed on crystalline structures and interactively rotated and manipulated.

Environment Modules¶

Run module spider xcrysden to find out what environment modules are available for this application.

Environment Variables¶

HPC_XCRYSDEN_DIR - installation directory
HPC_XCRYSDEN_BIN - executable directory

Citation¶

If you publish research that uses XCrySDen you have to cite it as follows:

A. Kokalj, Computer graphics and graphical user interfaces as tools in simulations of matter at the atomic scale, Comp. Mater. Sci., 2003, 28, 155--168.

Categories¶

material_science