Total scattering study of the orientational phase transition in para-terphenyl

DOI

There is currently a resurgence of interest in phase transitions in orientationally disordered molecular crystals. This is partly driven by the fact that new experimental and modelling tools now allow some of the open questions to be addressed properly for the first time, together with the need to understand the structural behaviour of molecular crystals for pharmaceutical applications. We are proposing to study the orientational ordering phase transition in para-terphenyl, C18H14, using total scattering with Reverse Monte Carlo analysis. This will enable us to address issues such as the determination of the orientational distribution function and the correlations between orientations of neighbouring molecules that drive the ordering phase transition.

Identifier
DOI https://doi.org/10.5286/ISIS.E.24078931
Metadata Access https://icatisis.esc.rl.ac.uk/oaipmh/request?verb=GetRecord&metadataPrefix=oai_datacite&identifier=oai:icatisis.esc.rl.ac.uk:inv/24078931
Provenance
Creator Professor Martin Dove; Professor Andrew Goodwin; Professor Simon Parsons; Dr Matthew Tucker; Mr Nick Funnell
Publisher ISIS Neutron and Muon Source
Publication Year 2012
Rights CC-BY Attribution 4.0 International; https://creativecommons.org/licenses/by/4.0/
OpenAccess true
Contact isisdata(at)stfc.ac.uk
Representation
Resource Type Dataset
Discipline Photon- and Neutron Geosciences
Temporal Coverage Begin 2009-12-04T19:43:16Z
Temporal Coverage End 2009-12-16T16:14:29Z