Beyond single-site disorder effects in first-principles studies of solid state systems
A generalization of the non-local coherent potential approximation (NL-CPA) for the treatment of short range ordering (SRO) effects in complex unit cell solids with different forms of disorder is proposed. The method is discussed with respect to fully first-principles Korringa, Kohn and Rostoker mul...
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University of Warwick
2011
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| Online Access: | http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.560128 |