XCrySDen

is aaiming at display of isosurfaces and contours, which can be superimposed on crystalline structures and interactively rotated and manipulated. It runs on GNU/Linux.

XCrySDen has been also ported to Mac OS (requires X11) and Windows (requires either CYGWIN or WSL).

The name of the program stands for Crystalline Structures and Densities and X because it runs under the X-Window environment.



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Latest version: 1.6.2

XCrySDen

mailing list is an open mailing list where XCrySDen related issues can be discussed among users.

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XCrySDen

is released under the GNU General Public License.

Whenever graphics generated by XCrySDen are used in scientific publications, it shall be greatly appreciated to include an explicit reference. The preferred form is the following:

XCrySDen

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.

, , , 155--168. A. Kokalj, XCrySDen--a new program for displaying crystalline structures and electron densities, J. Mol. Graphics Modelling , 1999 , 17 , 176--179.



, , , 176--179. A. Kokalj and M. Causà, Scientific Visualization in Computational Quantum Chemistry, Proceedings of High Performance Graphics Systems and Applications European Workshop, Bologna, Italy, 2000, 51--54.



has been described in the following papers: