The chemical response of main-group extended solids to formal mixed valency: the case of LixBC.
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.
Fogg
A M
AM
Department of Chemistry, University of Liverpool, Liverpool L69 7ZD, UK.
Darling
G R
GR
Claridge
J B
JB
Meldrum
J
J
Rosseinsky
M J
MJ