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The Journal of Chemical Physics
|
October 2, 2009
Modeling the polaronic nature of p-type defects in Cu2O: the failure of GGA and GGA + U
David O Scanlon, Benjamin J Morgan, Graeme W Watson
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
April 2, 2016
Modelling potential photovoltaic absorbers Cu3MCh4(M = V, Nb, Ta; Ch = S, Se, Te) using density functional theory
Aoife B Kehoe, David O Scanlon, Graeme W Watson
The Journal of Physical Chemistry Letters
|
November 4, 2015
(CH3NH3)2Pb(SCN)2I2: a more stable structural motif for hybrid halide photovoltaics?
Alex M Ganose, Christopher N Savory, David O Scanlon
Chemical Communications (Cambridge, England)
|
October 11, 2016
Beyond methylammonium lead iodide: prospects for the emergent field of ns<sup>2</sup> containing solar absorbers
Alex M Ganose, Christopher N Savory, David O Scanlon
The Journal of Chemical Physics
|
April 9, 2022
Machine learned calibrations to high-throughput molecular excited state calculations
Shomik Verma, Miguel Rivera, David O Scanlon, et al.
Chemistry of Materials : a Publication of the American Chemical Society
|
April 1, 2024
Computational Prediction of an Antimony-Based n-Type Transparent Conducting Oxide: F-Doped Sb<sub>2</sub>O<sub>5</sub>
Ke Li, Joe Willis, Seán R Kavanagh, et al.
Chemistry of Materials : a Publication of the American Chemical Society
|
June 19, 2018
Defect Engineering of Earth-Abundant Solar Absorbers BiSI and BiSeI
Alex M Ganose, Saya Matsumoto, John Buckeridge, et al.
ACS Applied Energy Materials
|
February 13, 2026
Computational Investigation of the Thermoelectric Performance of Environmentally Friendly and Earth-Abundant SrZn<sub>2</sub>S<sub>2</sub>O
Shipeng Bi, Katarina Brlec, Alexander G Squires, et al.
Faraday Discussions
|
August 4, 2022
Impact of metastable defect structures on carrier recombination in solar cells
Seán R Kavanagh, David O Scanlon, Aron Walsh, et al.
Materials Horizons
|
October 7, 2021
Hidden spontaneous polarisation in the chalcohalide photovoltaic absorber Sn<sub>2</sub>SbS<sub>2</sub>I<sub>3</sub>
Seán R Kavanagh, Christopher N Savory, David O Scanlon, et al.
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Search research articles
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Showing results (11-20 of 114) with videos related to
Sort By:
Page
of 12
The Journal of Chemical Physics
|
October 2, 2009
Modeling the polaronic nature of p-type defects in Cu2O: the failure of GGA and GGA + U
David O Scanlon, Benjamin J Morgan, Graeme W Watson
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
April 2, 2016
Modelling potential photovoltaic absorbers Cu3MCh4(M = V, Nb, Ta; Ch = S, Se, Te) using density functional theory
Aoife B Kehoe, David O Scanlon, Graeme W Watson
The Journal of Physical Chemistry Letters
|
November 4, 2015
(CH3NH3)2Pb(SCN)2I2: a more stable structural motif for hybrid halide photovoltaics?
Alex M Ganose, Christopher N Savory, David O Scanlon
Chemical Communications (Cambridge, England)
|
October 11, 2016
Beyond methylammonium lead iodide: prospects for the emergent field of ns<sup>2</sup> containing solar absorbers
Alex M Ganose, Christopher N Savory, David O Scanlon
The Journal of Chemical Physics
|
April 9, 2022
Machine learned calibrations to high-throughput molecular excited state calculations
Shomik Verma, Miguel Rivera, David O Scanlon, et al.
Chemistry of Materials : a Publication of the American Chemical Society
|
April 1, 2024
Computational Prediction of an Antimony-Based n-Type Transparent Conducting Oxide: F-Doped Sb<sub>2</sub>O<sub>5</sub>
Ke Li, Joe Willis, Seán R Kavanagh, et al.
Chemistry of Materials : a Publication of the American Chemical Society
|
June 19, 2018
Defect Engineering of Earth-Abundant Solar Absorbers BiSI and BiSeI
Alex M Ganose, Saya Matsumoto, John Buckeridge, et al.
ACS Applied Energy Materials
|
February 13, 2026
Computational Investigation of the Thermoelectric Performance of Environmentally Friendly and Earth-Abundant SrZn<sub>2</sub>S<sub>2</sub>O
Shipeng Bi, Katarina Brlec, Alexander G Squires, et al.
Faraday Discussions
|
August 4, 2022
Impact of metastable defect structures on carrier recombination in solar cells
Seán R Kavanagh, David O Scanlon, Aron Walsh, et al.
Materials Horizons
|
October 7, 2021
Hidden spontaneous polarisation in the chalcohalide photovoltaic absorber Sn<sub>2</sub>SbS<sub>2</sub>I<sub>3</sub>
Seán R Kavanagh, Christopher N Savory, David O Scanlon, et al.
Page
of 12