Difference between revisions of "XCrySDen"
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(Created page with "Category:Software {|<!--CONFIGURATION: REQUIRED--> |{{#vardefine:app|XCrySDen}} |{{#vardefine:url|http://www.xcrysden.org}} <!--CONFIGURATION: OPTIONAL (|1}} means it's ON...") |
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− | * HPC_{{ | + | * HPC_{{uc:{{#var:app}}}}_DIR : installation base directory |
− | * HPC_{{ | + | * HPC_{{uc:{{#var:app}}}}_BIN : executable program directory |
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If you publish research that uses {{#var:app}} you have to cite it as follows: | If you publish research that uses {{#var:app}} 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. | |
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|}} | |}} | ||
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+ | =Validation= | ||
+ | * Validated 4/5/2018 |
Revision as of 21:29, 6 December 2019
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.
Required Modules
Serial
- xcrysden
System Variables
- HPC_XCRYSDEN_DIR : installation base directory
- HPC_XCRYSDEN_BIN : executable program 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.
Validation
- Validated 4/5/2018