Slow cooling of hot polarons in halide perovskite solar cells JM Frost, LD Whalley, A Walsh
ACS energy letters 2 (12), 2647-2652, 2017
171 2017 Phonon anharmonicity, lifetimes, and thermal transport in LD Whalley, JM Skelton, JM Frost, A Walsh
Physical Review B 94 (22), 220301, 2016
171 2016 Perspective: Theory and simulation of hybrid halide perovskites LD Whalley, JM Frost, YK Jung, A Walsh
The Journal of chemical physics 146 (22), 2017
142 2017 Accumulation of deep traps at grain boundaries in halide perovskites JS Park, J Calbo, YK Jung, LD Whalley, A Walsh
ACS Energy Letters 4 (6), 1321-1327, 2019
141 2019 Impact of nonparabolic electronic band structure on the optical and transport properties of photovoltaic materials LD Whalley, JM Frost, BJ Morgan, A Walsh
Physical review B 99 (8), 085207, 2019
88 2019 The physical significance of imaginary phonon modes in crystals I Pallikara, P Kayastha, JM Skelton, LD Whalley
Electronic Structure 4 (3), 033002, 2022
81 2022 Intrinsic doping limit and defect-assisted luminescence in Cs 4 PbBr 6 YK Jung, J Calbo, JS Park, LD Whalley, S Kim, A Walsh
Journal of Materials Chemistry A 7 (35), 20254-20261, 2019
59 2019 H-center and V-center defects in hybrid halide perovskites LD Whalley, R Crespo-Otero, A Walsh
ACS Energy Letters 2 (12), 2713-2714, 2017
58 2017 Giant Huang–Rhys factor for electron capture by the iodine intersitial in perovskite solar cells LD Whalley, P Van Gerwen, JM Frost, S Kim, SN Hood, A Walsh
Journal of the American Chemical Society 143 (24), 9123-9128, 2021
53 2021 effmass: An effective mass package LD Whalley
Journal of Open Source Software 3 (28), 797, 2018
41 2018 Quick-start guide for first-principles modelling of point defects in crystalline materials S Kim, SN Hood, JS Park, LD Whalley, A Walsh
JPhys Energy 2 (3), 036001, 2020
39 2020 Carriercapture. jl: Anharmonic carrier capture S Kim, SN Hood, P van Gerwen, LD Whalley, A Walsh
Journal of Open Source Software 5 (47), 2102, 2020
24 2020 High‐Temperature Equilibrium of 3D and 2D Chalcogenide Perovskites P Kayastha, D Tiwari, A Holland, OS Hutter, K Durose, LD Whalley, ...
Solar RRL 7 (9), 2201078, 2023
11 2023 Modelling interfaces in thin-film photovoltaic devices MDK Jones, JA Dawson, S Campbell, V Barrioz, LD Whalley, Y Qu
Frontiers in Chemistry 10, 920676, 2022
9 2022 Roadmap on Photovoltaic Absorber Materials for Sustainable Energy Conversion JC Blakesley, RS Bonilla, M Freitag, AM Ganose, N Gasparini, ...
arXiv preprint arXiv:2310.19430, 2023
5 2023 A first-principles thermodynamic model for the Ba-Zr-S system in equilibrium with sulfur vapour P Kayastha, G Longo, LD Whalley
ACS Applied Energy Materials, 2024
2 2024 Steric Engineering of Point Defects in Lead Halide Perovskites LD Whalley
The Journal of Physical Chemistry C 127 (32), 15738–15746, 2023
1 2023 Octahedral tilt-driven phase transitions in BaZrS3 chalcogenide perovskite P Kayastha, E Fransson, P Erhart, LD Whalley
arXiv preprint arXiv:2411.14289, 2024
2024 Celebrating and supporting early career researchers within underrepresented groups in materials science A Ramadan, L Whalley, M Coke, Y Liu, N Lok Kwan Li
Nature Communications 15, 4030, 2024
2024 Defects and distortions in hybrid halide perovskites L Whalley
Imperial College London, 2020
2020 
Aron WalshDepartment of Materials, Imperial College LondonBestätigte E-Mail-Adresse bei imperial.ac.uk