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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 36, 1978 - Issue 5
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Original Articles

Lattice integrals for the energy of disordered solids with long-range interparticle interactions

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Pages 1335-1340 | Received 07 Mar 1978, Published online: 23 Aug 2006
 

Abstract

We introduce a model hard-sphere solid with correlation functions in excellent agreement with hard-sphere solid correlation functions calculated from simulations. The model solid is of independently distributed Gaussian particles centred at the points of a face-centred cubic lattice. We generalize the model to any lattice and use it to calculate contributions to the internal energy due to long-ranged potentials.

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