Published in
Royal Society of Chemistry, Journal of Materials Chemistry A: materials for energy and sustainability, 24(11), p. 13016-13026, 2023
DOI: 10.1039/d2ta10037a
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Anion-polarisation-directed short-range-order in antiperovskite Li<sub>2</sub>FeSO
Journal article published in 2023 by
Samuel W. Coles 
,
Viktoria Falkowski,
Harry S. Geddes ,
Gabriel E. Pérez ,
Samuel G. Booth ,
Alexander G. Squires ,
Conn O'Rourke,
Kit McColl ,
Andrew L. Goodwin,
Serena A. Cussen,
Simon J. Clarke ,
M. Saiful Islam ,
Benjamin J. Morgan
,
Viktoria Falkowski,
Harry S. Geddes ,
Gabriel E. Pérez ,
Samuel G. Booth ,
Alexander G. Squires ,
Conn O'Rourke,
Kit McColl ,
Andrew L. Goodwin,
Serena A. Cussen,
Simon J. Clarke ,
M. Saiful Islam ,
Benjamin J. Morgan
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Abstract
Anion polarisation in heterocationic Li2FeSO stabilises polar anion coordination in opposition to the predictions from simple point-charge electrostatics. This behaviour gives local configurational under-constraint and causes long-range disorder.