The computational solid state chemistry group develops and maintains a number of atomistic simulation codes. Two codes are currently being developed and supported.

PARAPOCS (free energy mimisation based on lattice dynamics)

METADISE (two and one dimensional defect simulation allowing dislocations, surfaces and interfaces to be studied)

Computational solid state chemistry group home page

page design by Graeme Watson and Pete Oliver.
Send your comments and questions to s.c.parker@bath.ac.uk.