The chemical response of main-group extended solids to formal mixed valency: the case of LixBC
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From Molecules to Materials: Engineering New Ionic Liquid Crystals Through Halogen Bonding
Published on: March 24, 2018
A M Fogg1, G R Darling, J B Claridge
1Department of Chemistry, University of Liverpool, Liverpool L69 7ZD, UK.
Abstract:
The introduction of mixed valency into extended main-group solids is discussed using the example of hole-doped LiBC, where a combination of experimental measurements and density functional theory calculations is used to understand the observed electronic properties in terms of deviation from the expected rigid-band electronic structure behaviour.
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