ISIS Neutron and Muon Source Data Journal

This is a page describing data taken during an experiment at the ISIS Neutron and Muon Source. Information about the ISIS Neutron and Muon Source can be found at https://www.isis.stfc.ac.uk.


Structural origin of negative thermal expansion in ScF3

Abstract: Scandium fluoride has recently been identified as a very simple example of a material showing negative thermal expansion over a wide range of temperatures. In particular, it might be thought to illustrate the classic mechanism of thermally excited octahedral rotations causing shrinkage of the crystal on heating. However, recent work has suggested that the dynamics are much more anharmonic than suggested by this picture. We are proposing a total scattering experiment, with results to be analysed by the Reverse Monte Carlo method. Previous successes with this method on perovskites suggest that this approach should be capable of giving a good structural understanding of the processes that lead to negative thermal expansion.

Principal Investigator: Professor Martin Dove
Experimenter: Dr Matthew Tucker
Experimenter: Miss Tingting Zhang
Experimenter: Dr Anthony Phillips
Experimenter: Miss Juan Du

DOI: 10.5286/ISIS.E.RB1510519

ISIS Experiment Number: RB1510519

Part DOI Instrument Public release date Download Link
10.5286/ISIS.E.58450000 POLARIS 13 April 2018 Download

Publisher: STFC ISIS Neutron and Muon Source

Data format: RAW/Nexus
Select the data format above to find out more about it.

Data Citation

The recommended format for citing this dataset in a research publication is as:
[author], [date], [title], [publisher], [doi]

For Example:
Professor Martin Dove et al; (2015): Structural origin of negative thermal expansion in ScF3, STFC ISIS Neutron and Muon Source, https://doi.org/10.5286/ISIS.E.RB1510519

Data is released under the CC-BY-4.0 license.



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