On the use of symmetry in configurational analysis for the simulation of disordered solids

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On the use of symmetry in configurational analysis for the simulation of disordered solids

The starting point for a quantum mechanical investigation of disordered systems usually implies calculations on a limited subset of configurations, generated by defining either the composition of interest or a set of compositions ranging from one end member to another, within an appropriate supercel...

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Bibliographic Details
Main Authors:	Mustapha, S., D'Arco, P., De La Pierre, Marco, Noël, Y., Ferrabone, M., Dovesi, R.
Format:	Journal Article
Published:	Institute of Physics Publishing Ltd. 2013
Online Access:	http://hdl.handle.net/20.500.11937/7236

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