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Seán Kavanagh

13 results in Authors: Seán Kavanagh

Chemistry

Review

Guidelines for robust and reproducible point defect simulations in crystals

Alexander G. Squires, Seán Kavanagh, Aron Walsh, David Scanlon

Version 1 posted 26 September 2025

1,212

Downloads

Citations

Chemistry

Working Paper

Defect Tolerance via External Passivation in the Photocatalyst SrTiO3:Al

Kanta Ogawa, Seán R Kavanagh, Fumiyasu Oba, Aron Walsh

Version 1 posted 13 May 2025

485

Downloads

Chemistry

Working Paper

Enhanced visible light absorption in layered Cs3Bi2Br9 through mixed-valence Sn(II) / Sn(IV) doping

Chantalle Krajewska, Seán Kavanagh, Lina Zhang, Dominik Kubicki, Krishanu Dey, Krzysztof Gałkowski, Clare Grey, Samuel Stranks, Aron Walsh, David Scanlon, Robert Palgrave

Version 1 posted 12 July 2021

210

Downloads

Chemistry

Working Paper

Enhanced visible light absorption in layered Cs3Bi2Br9 through mixed-valence Sn(II) / Sn(IV) doping

Chantalle Krajewska, Seán Kavanagh, Lina Zhang, Dominik Kubicki, Krishanu Dey, Krzysztof Gałkowski, Clare Grey, Samuel Stranks, Aron Walsh, David Scanlon, Robert Palgrave

Version 1 posted 12 July 2021

933

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Chemistry

Working Paper

Frenkel Excitons in Vacancy-ordered Titanium Halide Perovskites (Cs₂TiX₆)

Seán R. Kavanagh, Christopher N. Savory, Shanti M. Liga, Gerasimos Konstantatos, Aron Walsh, David O. Scanlon

Version 3 posted 03 November 2022

1,359

Downloads

Chemistry

Working Paper

Mixed-Cation Vacancy-Ordered Perovskites (Cs₂Ti₁₋ₓSnₓX₆; X = I, Br): High Miscibility, Additivity and Tunable Stability

Shanti Liga, Seán R. Kavanagh, Aron Walsh, David O. Scanlon, Gerasimos Konstantatos

Version 2 posted 22 September 2023

1,114

Downloads

Citations

Chemistry

Working Paper

Giant Band Degeneracy via Orbital Engineering Enhances Thermoelectric Performance from Sb2Si2Te6 to Sc2Si2Te6

Wenzhen Dou, Kieran Spooner, Seán Kavanagh, Miao Zhou, David O. Scanlon

Version 1 posted 09 January 2024

771

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Citations

Chemistry

Working Paper

Intrinsic point defect tolerance in selenium for indoor and tandem photovoltaics

Seán R. Kavanagh, Rasmus S. Nielsen, John L. Hansen, Rasmus S. Davidsen, Ole Hansen, Alp E. Samli, Peter C. Vesborg, David O. Scanlon, Aron Walsh

Version 2 posted 28 March 2025

969

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Chemistry

Working Paper

Interplay of static and dynamic disorder in the mixed-metal chalcohalide Sn₂SbS₂I₃

Adair Nicolson, Joachim Breternitz, Seán R. Kavanagh, Yvonne Tomm, Kazuki Morita, Alexander G. Squires, Michael Tovar, Aron Walsh, Susan Schorr, David O. Scanlon

Version 2 posted 27 December 2022

723

Downloads

Chemistry

Working Paper

Computational Prediction of an Antimony-based n-type Transparent Conducting Oxide: F-doped Sb2O5

Ke Li, Joe Willis, Seán R. Kavanagh, David O. Scanlon

Version 1 posted 22 December 2023

523

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13 results in Seán Kavanagh in Authors: Seán Kavanagh

Guidelines for robust and reproducible point defect simulations in crystals

Defect Tolerance via External Passivation in the Photocatalyst SrTiO3:Al

Enhanced visible light absorption in layered Cs3Bi2Br9 through mixed-valence Sn(II) / Sn(IV) doping

Enhanced visible light absorption in layered Cs3Bi2Br9 through mixed-valence Sn(II) / Sn(IV) doping

Frenkel Excitons in Vacancy-ordered Titanium Halide Perovskites (Cs₂TiX₆)

Mixed-Cation Vacancy-Ordered Perovskites (Cs₂Ti₁₋ₓSnₓX₆; X = I, Br): High Miscibility, Additivity and Tunable Stability

Giant Band Degeneracy via Orbital Engineering Enhances Thermoelectric Performance from Sb2Si2Te6 to Sc2Si2Te6

Intrinsic point defect tolerance in selenium for indoor and tandem photovoltaics

Interplay of static and dynamic disorder in the mixed-metal chalcohalide Sn₂SbS₂I₃

Computational Prediction of an Antimony-based n-type Transparent Conducting Oxide: F-doped Sb2O5

13 results in Authors: Seán Kavanagh