Published in
Royal Society of Chemistry, CrystEngComm, 31(25), p. 4417-4426, 2023
DOI: 10.1039/d3ce00432e
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Novel high-temperature phase and crystal structure evolution of CsCuBr<sub>3</sub> halide identified by neutron powder diffraction
Journal article published in 2023 by
Carmen Abia,
Carlos A. López 
,
Javier Gainza ,
João Elias F. S. Rodrigues ,
María T. Fernández-Díaz ,
Eva Céspedes ,
José Luis Martínez ,
José Antonio Alonso
,
Javier Gainza ,
João Elias F. S. Rodrigues ,
María T. Fernández-Díaz ,
Eva Céspedes ,
José Luis Martínez ,
José Antonio Alonso
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Abstract
CsCuBr3 presents an orthorhombic phase (C2221) at 20–400 K, comprising dimer units of face-sharing [CuBr6] octahedra. At 420 K, a novel high-temperature phase is identified (P6522) containing infinite chains of [CuBr4] square-planar units.