Calculation of the free energy of crystalline solids

The prediction of the packing of molecules into crystalline phases is a key step in understanding the properties of solids. Of particular interest is the phenomenon of polymorphism, which refers to the ability of one compound to form crystals with different structures, which have identical chemical...

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Bibliographic Details
Main Author: Vasileiadis, Manolis
Other Authors: Adjiman, Claire S. J. : Pantelides, Constantinos C.
Published: Imperial College London 2013
Subjects:
660
Online Access:http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.587340