Reverse Monte Carlo modelling of crystalline disorder

Keen, D. A. and Tucker, M. G. and Dove, M. T. (2005) Reverse Monte Carlo modelling of crystalline disorder. Journal of Physics: Condensed Matter, 17. S15-S22. DOI 10.1088/0953-8984/17/5/002

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Abstract

The reverse Monte Carlo (RMC) modelling method, although initially developed for interpreting structural data fromliquids and amorphousmaterials, has been extensively applied to similar data from crystalline systems. This has been especially beneficial for materials which display a large amount of disorder. The work in this are a will be briefly reviewed here, including a summary of the range of crystalline materials which have been studied using RMCmodelling. Recent developments made specifically to improve the RMC modelling method for crystalline systems will also be described.

Item Type: Article
Uncontrolled Keywords: 2005 AREP 2005 P IA48
Subjects: 03 - Mineral Sciences
Divisions: 03 - Mineral Sciences
Journal or Publication Title: Journal of Physics: Condensed Matter
Volume: 17
Page Range: S15-S22
Identification Number: 10.1088/0953-8984/17/5/002
Depositing User: Sarah Humbert
Date Deposited: 03 Mar 2011 15:56
Last Modified: 23 Jul 2013 09:59
URI: http://eprints.esc.cam.ac.uk/id/eprint/1709

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