Ferroelectric transitions in potentially multiferroic Mn-formate frameworks

DOI

The perovskite-like family of ammonium formate frameworks AB(HCO2)3, where A is a divalent metal ion and B is an (alkyl)ammonium or guanadinium, is of great interest for its potential multiferroic properties. We intend to characterise the (anti)ferroelectric order-disorder transition of the compounds A = Mn, B = ND4+ or ND2(CD3)2+ by reverse Monte Carlo modelling of total neutron diffraction data. These data will allow us to model the local structural changes across the transition, in particular the distortions in framework structure as the guests freeze into their low-temperature positions. Furthermore, we will characterise any correlations or cooperativity between adjacent guest sites. Modelling the dynamical effects responsible for the electric phase transition in these frameworks will be an important step towards the aim of producing multiferroics by design.

Identifier
DOI https://doi.org/10.5286/ISIS.E.24089276
Metadata Access https://icatisis.esc.rl.ac.uk/oaipmh/request?verb=GetRecord&metadataPrefix=oai_datacite&identifier=oai:icatisis.esc.rl.ac.uk:inv/24089276
Provenance
Creator Professor Martin Dove; Professor Alan Drew; Dr Anthony Phillips; Mr Edward Beake; Dr Viswanathan Mohandoss
Publisher ISIS Neutron and Muon Source
Publication Year 2020
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 2012-07-27T09:56:44Z
Temporal Coverage End 2017-05-16T14:16:40Z