David Scanlon
David Scanlon
Professor of Computational Materials Design at University College London
Verified email at ucl.ac.uk - Homepage
TitleCited byYear
Band alignment of rutile and anatase TiO2
DO Scanlon, CW Dunnill, J Buckeridge, SA Shevlin, AJ Logsdail, ...
Nature materials 12 (9), 798, 2013
13932013
Theoretical and experimental study of the electronic structures of MoO3 and MoO2
DO Scanlon, GW Watson, DJ Payne, GR Atkinson, RG Egdell, DSL Law
The Journal of Physical Chemistry C 114 (10), 4636-4645, 2010
3682010
Self‐regulation mechanism for charged point defects in hybrid halide perovskites
A Walsh, DO Scanlon, S Chen, XG Gong, SH Wei
Angewandte Chemie International Edition 54 (6), 1791-1794, 2015
2782015
On the application of the tolerance factor to inorganic and hybrid halide perovskites: a revised system
W Travis, ENK Glover, H Bronstein, DO Scanlon, RG Palgrave
Chemical science 7 (7), 4548-4556, 2016
2262016
Acceptor levels in p-type Cu 2 O: rationalizing theory and experiment
DO Scanlon, BJ Morgan, GW Watson, A Walsh
Physical Review Letters 103 (9), 096405, 2009
2262009
Controlling Bulk Conductivity in Topological Insulators: Key Role of Anti‐Site Defects
DO Scanlon, PDC King, RP Singh, A De La Torre, SMK Walker, ...
Advanced Materials 24 (16), 2154-2158, 2012
1812012
An ab initio Study of Reduction of V2O5 through the Formation of Oxygen Vacancies and Li Intercalation
DO Scanlon, A Walsh, BJ Morgan, GW Watson
The Journal of Physical Chemistry C 112 (26), 9903-9911, 2008
1752008
Beyond methylammonium lead iodide: prospects for the emergent field of ns 2 containing solar absorbers
AM Ganose, CN Savory, DO Scanlon
Chemical Communications 53 (1), 20-44, 2017
1582017
Understanding the p-type defect chemistry of CuCrO 2
DO Scanlon, GW Watson
Journal of Materials Chemistry 21 (11), 3655-3663, 2011
1502011
Can Pb-free halide double perovskites support high-efficiency solar cells?
CN Savory, A Walsh, DO Scanlon
ACS energy letters 1 (5), 949-955, 2016
1472016
Sources of conductivity and doping limits in CdO from hybrid density functional theory
M Burbano, DO Scanlon, GW Watson
Journal of the American Chemical Society 133 (38), 15065-15072, 2011
1452011
Role of lattice distortions in the oxygen storage capacity of divalently doped CeO2
AB Kehoe, DO Scanlon, GW Watson
Chemistry of Materials 23 (20), 4464-4468, 2011
1422011
Small polarons in Nb-and Ta-doped rutile and anatase TiO 2
BJ Morgan, DO Scanlon, GW Watson
Journal of Materials Chemistry 19 (29), 5175-5178, 2009
1302009
Analysis of intrinsic defects in CeO2 using a Koopmans-like GGA+ U approach
PRL Keating, DO Scanlon, BJ Morgan, NM Galea, GW Watson
The Journal of Physical Chemistry C 116 (3), 2443-2452, 2012
1152012
On the possibility of p-type SnO 2
DO Scanlon, GW Watson
Journal of Materials Chemistry 22 (48), 25236-25245, 2012
1152012
Modeling the polaronic nature of -type defects in : The failure of GGA and
DO Scanlon, BJ Morgan, GW Watson
The Journal of chemical physics 131 (12), 124703, 2009
1152009
Defect engineering of BaSnO 3 for high-performance transparent conducting oxide applications
DO Scanlon
Physical Review B 87 (16), 161201, 2013
1122013
Undoped n-type Cu2O: fact or fiction?
DO Scanlon, GW Watson
The Journal of Physical Chemistry Letters 1 (17), 2582-2585, 2010
1092010
Effect of Cr substitution on the electronic structure of CuAl 1− x Cr x O 2
DO Scanlon, A Walsh, BJ Morgan, GW Watson, DJ Payne, RG Egdell
Physical Review B 79 (3), 035101, 2009
1062009
Bismuth oxyhalides: synthesis, structure and photoelectrochemical activity
DS Bhachu, SJA Moniz, S Sathasivam, DO Scanlon, A Walsh, ...
Chemical science 7 (8), 4832-4841, 2016
1012016
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