Modelling in relation to cation ordering

Modelling in relation to cation ordering

We review the methodology of using computer models to obtain quantitative information about cation ordering. Empirical interactomic potentials or ab initio electronic structure calculations are used to generate the energies for many configurations containing disordered arrangements of cations, and t...

Полное описание

Библиографические подробности
Главные авторы:	Dove, M, Bosenick, A, Myers, E, Warren, M, Redfern, S
Формат:	Journal article
Язык:	English
Опубликовано:	Gordon and Breach Science Publ Inc 2000

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