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...
| Main Authors: | , , , , , |
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| Format: | Journal Article |
| Published: |
Institute of Physics Publishing Ltd.
2013
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| Online Access: | http://hdl.handle.net/20.500.11937/7236 |