CCP5: The Computer Simulation of Condensed Phases

Allan, Neil L (Principal Investigator)

School of Chemistry

Status	Finished
Effective start/end date	1/04/15 → 30/09/21
Links	http://gtr.rcuk.ac.uk/projects?ref=EP/M022617/1

Research Groups and Themes

Physical & Theoretical

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Project entry on Gateway to Research

Multiple Cascade Radiation Damage Simulations of Pyrochlore
Archer, A., Foxhall, H. R., Allan, N. L., Shearer, J. R. W., Gunn, D., Harding, J., Todorov, I., Travis, K. P. & Purton, J., 28 Oct 2020, In: Molecular Simulation. 12 p.
Research output: Contribution to journal › Article (Academic Journal) › peer-review

Open Access
File
4 Citations (Scopus)

123 Downloads (Pure)
Simulations of doped CeO₂ at finite dopant concentrations
Purton, J., Allan, N. & Gunn, D., Jan 2017, In: Solid State Ionics. 299, p. 32–37 6 p.
Research output: Contribution to journal › Article (Academic Journal) › peer-review

Open Access
File
21 Citations (Scopus)

482 Downloads (Pure)
Growth of nano-domains in Gd-CeO₂ mixtures: Hybrid Monte Carlo simulations
Purton, J., Archer, A., Allan, N. L. & Gunn, D. S. D., 1 Mar 2016, In: Journal of Materials Chemistry A. 4, 12, p. 4592-4602 11 p.
Research output: Contribution to journal › Article (Academic Journal) › peer-review

Open Access
File
23 Citations (Scopus)

394 Downloads (Pure)