Local structure study of the order/disorder ferroelectric transition in [ND4][Zn(DCOO)3]

DOI

We will carry out a definitive local structure investigation of the ferroelectric transition in [ND4][Zn(DCOO)3]. This compound is seen as the canonical example of a ferroeletric MOF; yet little is known concerning the structural and dynamical origin of its mechanical behaviour. We will use neutron total scattering, coupled with atomistic structural refinement, to obtain the following: (1) The first comprehensive structural characterisation of the paraelectric/ferroelectric transition, including measurement of critical behaviour in terms of local and long-range order parameters; (2) An understanding of the emergence and role of disorder/order within the ferroelectric/paraelectric phases as the transition is approached from either side of Tc; (3) Measurement of the rotovibrational dispersion spectrum and hence the mode-softening responsible for driving the transition.

Identifier
DOI https://doi.org/10.5286/ISIS.E.24089264
Metadata Access https://icatisis.esc.rl.ac.uk/oaipmh/request?verb=GetRecord&metadataPrefix=oai_datacite&identifier=oai:icatisis.esc.rl.ac.uk:inv/24089264
Provenance
Creator Professor Andrew Goodwin; Professor David Keen; Dr Matthew Tucker; Dr Ines Collings; Mr Callum Young; Dr Andrew Cairns; Dr Nicholas Funnell
Publisher ISIS Neutron and Muon Source
Publication Year 2015
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 2012-07-22T12:27:03Z
Temporal Coverage End 2012-07-27T09:56:33Z