Inter-atomic potentials for radiation damage studies in CePO4 monazite

An original empirical potential used for modelling phosphate glasses is adapted to be suitable for use with monazite (CePO4) so as to have a consistent formulation for radiation damage studies of phosphates. This is done by adding a parameterisation for the Ce–O interaction to the existing potential...

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Bibliographic Details

Main Authors:	Kenny Jolley, Rajaram Asuvathrahman, Roger Smith
Format:	Default Article
Published:	2017
Subjects:	Other mathematical sciences not elsewhere classified Potential fitting Monazite Thermal properties Mathematical Sciences not elsewhere classified
Online Access:	https://hdl.handle.net/2134/22991
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