Benjamin J. Morgan
Benjamin J. Morgan
Royal Society University Research Fellow, Department of Chemistry, University of Bath
Verified email at bath.ac.uk - Homepage
TitleCited byYear
A DFT+U description of oxygen vacancies at the TiO2 rutile (110) surface
BJ Morgan, GW Watson
Surface Science 601 (21), 5034-5041, 2007
3842007
Intrinsic n-type Defect Formation in TiO2: A Comparison of Rutile and Anatase from GGA+ U Calculations
BJ Morgan, GW Watson
The Journal of Physical Chemistry C 114 (5), 2321-2328, 2010
3062010
Acceptor Levels in p-Type Cu2O: Rationalizing Theory and Experiment
DO Scanlon, BJ Morgan, GW Watson, A Walsh
Physical Review Letters 103 (9), 96405, 2009
2262009
Polaronic trapping of electrons and holes by native defects in anatase TiO2
BJ Morgan, GW Watson
Physical Review B 80 (23), 233102, 2009
1982009
A Density Functional Theory+ U Study of Oxygen Vacancy Formation at the (110),(100),(101), and (001) Surfaces of Rutile TiO2
BJ Morgan, GW Watson
The Journal of Physical Chemistry C 113 (17), 7322-7328, 2009
1792009
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
Small polarons in Nb-and Ta-doped rutile and anatase TiO2
BJ Morgan, DO Scanlon, GW Watson
J. Mater. Chem. 19 (29), 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
Modeling the polaronic nature of p-type defects in CuO: The failure of GGA and GGA+ U
DO Scanlon, BJ Morgan, GW Watson
The Journal of chemical physics 131, 124703, 2009
1152009
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
Understanding conductivity anomalies in Cu-based delafossite transparent conducting oxides: Theoretical insights
DO Scanlon, KG Godinho, BJ Morgan, GW Watson
The Journal of chemical physics 132, 024707, 2010
982010
Reversible magnesium and aluminium ions insertion in cation-deficient anatase TiO2
T Koketsu, J Ma, BJ Morgan, M Body, C Legein, W Dachraoui, M Giannini, ...
Nature materials 16 (11), 1142, 2017
932017
Surface sensitivity in lithium-doping of MgO: a density functional theory study with correction for on-site Coulomb interactions
DO Scanlon, A Walsh, BJ Morgan, M Nolan, J Fearon, GW Watson
The Journal of Physical Chemistry C 111 (22), 7971-7979, 2007
932007
GGA+ U description of lithium intercalation into anatase TiO_ {2}
BJ Morgan, GW Watson
Physical Review B 82 (14), 144119, 2010
922010
X-ray spectroscopic study of the electronic structure of CuCrO_ {2}
T Arnold, DJ Payne, A Bourlange, JP Hu, RG Egdell, LFJ Piper, ...
Physical Review B 79 (7), 075102, 2009
872009
Ion mobilities and microscopic dynamics in liquid (Li, K) Cl
B Morgan, PA Madden
The Journal of chemical physics 120 (3), 1402-1413, 2004
682004
The origin of the enhanced oxygen storage capacity of Ce 1− x (Pd/Pt) x O 2
DO Scanlon, BJ Morgan, GW Watson
Physical Chemistry Chemical Physics 13 (10), 4279-4284, 2011
642011
Understanding the Electronic Structure of IrO 2 Using Hard-X-ray Photoelectron Spectroscopy and Density-Functional Theory
JM Kahk, CG Poll, FE Oropeza, JM Ablett, D Céolin, JP Rueff, S Agrestini, ...
Physical review letters 112 (11), 117601, 2014
632014
Reactivity on the (110) Surface of Ceria: A GGA+ U Study of Surface Reduction and the Adsorption of CO and NO2
DO Scanlon, NM Galea, BJ Morgan, GW Watson
The Journal of Physical Chemistry C 113 (25), 11095-11103, 2009
622009
Preferential stability of the d-BCT phase in ZnO thin films
BJ Morgan
Physical Review B 80 (17), 174105, 2009
422009
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Articles 1–20