The computer simulation of the structure of point defects in copper

The atomic structures and formation energies and volumes of a copper crystal for a series of single and multiple point defects have been calculated by real-space computer modelling techniques. Stable and metastable defect configurations were obtained by iteratively minimizing the potential energy of...

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Bibliographic Details
Main Author: Doneghan, Michael
Published: University of Surrey 1976
Subjects:
669
Online Access:https://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.453825