Reverse Monte Carlo modelling of crystalline disorder
Reverse Monte Carlo modelling of crystalline disorder
复制标题
晶体无序的逆蒙特卡罗建模
DOI:
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发表时间:
2005
期刊:
影响因子:
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通讯作者:
M. Dove
中科院分区:
文献类型:
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作者:
D. Keen;M. Tucker;M. Dove
The reverse Monte Carlo (RMC) modelling method, although initially developed for interpreting structural data from liquids and amorphous materials, 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 area will be briefly reviewed here, including a summary of the range of crystalline materials which have been studied using RMC modelling. Recent developments made specifically to improve the RMC modelling method for crystalline systems will also be described.