Artikel mit Open-Access-Mandaten - David ScanlonWeitere Informationen
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Defect engineering of BaSnO for high-performance transparent conducting oxide applications
DO Scanlon
Physical Review B—Condensed Matter and Materials Physics 87 (16), 161201, 2013
Mandate: UK Engineering and Physical Sciences Research Council
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
Mandate: Science Foundation Ireland
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
Mandate: Science Foundation Ireland
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
Mandate: Science Foundation Ireland
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
Mandate: Science Foundation Ireland
Undoped n-Type Cu2O: Fact or Fiction?
DO Scanlon, GW Watson
The Journal of Physical Chemistry Letters 1 (17), 2582-2585, 2010
Mandate: Science Foundation Ireland
Origin of the bipolar doping behavior of SnO from X-ray spectroscopy and density functional theory
NF Quackenbush, JP Allen, DO Scanlon, S Sallis, JA Hewlett, AS Nandur, ...
Chemistry of Materials 25 (15), 3114-3123, 2013
Mandate: UK Engineering and Physical Sciences Research Council
Understanding the p-Type Conduction Properties of the Transparent Conducting Oxide CuBO2: A Density Functional Theory Analysis
DO Scanlon, A Walsh, GW Watson
Chemistry of Materials 21 (19), 4568-4576, 2009
Mandate: Science Foundation Ireland
Geometry, Electronic Structure, and Bonding in CuMCh2(M = Sb, Bi; Ch = S, Se): Alternative Solar Cell Absorber Materials?
DJ Temple, AB Kehoe, JP Allen, GW Watson, DO Scanlon
The Journal of Physical Chemistry C 116 (13), 7334-7340, 2012
Mandate: Science Foundation Ireland
Tin monoxide: Structural prediction from first principles calculations with van der waals corrections
JP Allen, DO Scanlon, SC Parker, GW Watson
The Journal of Physical Chemistry C 115 (40), 19916-19924, 2011
Mandate: Science Foundation Ireland
The electronic structure of the antimony chalcogenide series: Prospects for optoelectronic applications
JJ Carey, JP Allen, DO Scanlon, GW Watson
Journal of Solid State Chemistry 213, 116-125, 2014
Mandate: Science Foundation Ireland
Elucidating the Nature of Pseudo Jahn–Teller Distortions in LixMnPO4: Combining Density Functional Theory with Soft and Hard X-ray Spectroscopy
LFJ Piper, NF Quackenbush, S Sallis, DO Scanlon, GW Watson, KW Nam, ...
The Journal of Physical Chemistry C 117 (20), 10383-10396, 2013
Mandate: Science Foundation Ireland, UK Engineering and Physical Sciences Research …
(Cu2S2)(Sr3Sc2O5)−A Layered, Direct Band Gap, p-Type Transparent Conducting Oxychalcogenide: A Theoretical Analysis.
DO Scanlon, GW Watson
Chemistry of Materials 21 (22), 5435-5442, 2009
Mandate: Science Foundation Ireland
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
Mandate: Science Foundation Ireland
Intrinsic ferromagnetism in CeO2: dispelling the myth of vacancy site localization mediated superexchange
PRL Keating, DO Scanlon, GW Watson
Journal of Physics: Condensed Matter 21 (40), 405502, 2009
Mandate: Science Foundation Ireland
Combinatorial Atmospheric Pressure Chemical Vapor Deposition of F:TiO2; the Relationship between Photocatalysis and Transparent Conducting Oxide Properties
A Kafizas, N Noor, P Carmichael, DO Scanlon, CJ Carmalt, IP Parkin
Advanced Functional Materials 24 (12), 1758-1771, 2014
Mandate: UK Engineering and Physical Sciences Research Council
Chemical and structural indicators for large redox potentials in Fe-based positive electrode materials
BC Melot, DO Scanlon, M Reynaud, G Rousse, JN Chotard, M Henry, ...
ACS Applied Materials & Interfaces 6 (14), 10832-10839, 2014
Mandate: UK Engineering and Physical Sciences Research Council
The nature of oxygen states on the surfaces of CeO2 and La-doped CeO2
PRL Keating, DO Scanlon, GW Watson
Chemical Physics Letters 608, 239-243, 2014
Mandate: Science Foundation Ireland, UK Engineering and Physical Sciences Research …
Assessing the potential of Mg-doped Cr2O3 as a novel p-type transparent conducting oxide
AB Kehoe, E Arca, DO Scanlon, IV Shvets, GW Watson
Journal of Physics: Condensed Matter 28 (12), 125501, 2016
Mandate: Higher Education Authority, Ireland, Science Foundation Ireland, UK …
Modelling potential photovoltaic absorbers Cu3MCh4 (M= V, Nb, Ta; Ch= S, Se, Te) using density functional theory
AB Kehoe, DO Scanlon, GW Watson
Journal of Physics: Condensed Matter 28 (17), 175801, 2016
Mandate: Science Foundation Ireland, UK Engineering and Physical Sciences Research …
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