papers
Publications (11)
cond-mat.mtrl-sci2016
Microscopic origin of entropy-driven polymorphism in hybrid organic-inorganic perovskite materials
Keith T. Butler, Gregor Kieslich, Katrine Svane +2
cond-mat.mtrl-sci2018
Quick-start guide for first-principles modelling of semiconductor interfaces
Ji-Sang Park, Young-Kwang Jung, Keith T. Butler +1
cond-mat.mes-hall2014
Molecular ferroelectric contributions to anomalous hysteresis in hybrid perovskite solar cells
Jarvist M. Frost, Keith T. Butler, Aron Walsh
cond-mat.mtrl-sci2014
Electronic chemical potentials of porous metal-organic frameworks
Keith T. Butler, Christopher H. Hendon, Aron Walsh
cond-mat.mtrl-sci2014
Relativistic quasiparticle self-consistent electronic structure of hybrid halide perovskite photovoltaic absorbers
Federico Brivio, Keith T. Butler, Aron Walsh +1
physics.comp-ph2018
Band Engineering of Carbon Nitride Monolayers by N-type, P-type, and Isoelectronic Doping for Photocatalytic Applications
Meysam Makaremi, Sean Grixti, Keith T. Butler +2
cond-mat.mtrl-sci2015
Crystal structure optimisation using an auxiliary equation of state
Adam J. Jackson, Jonathan M. Skelton, Christopher H. Hendon +2
cond-mat.mtrl-sci2019
Metal-free perovskites for non-linear optical materials
Thomas W. Kasel, Zeyu Deng, Austin M. Mroz +3
cond-mat.mtrl-sci2018
Finding a junction partner for candidate solar cell absorbers enargite and bournonite from electronic band and lattice matching
Suzanne K. Wallace, Keith T. Butler, Yoyo Hinuma +1
cond-mat.mtrl-sci2014
Ferroelectric Materials for Solar Energy Conversion: Photoferroics Revisited
Keith T. Butler, Jarvist M. Frost, Aron Walsh
cond-mat.mtrl-sci2014
Atomistic origins of high-performance in hybrid halide perovskite solar cells
Jarvist M. Frost, Keith T. Butler, Federico Brivio +3