Lattice dynamics and vibrational spectra of the orthorhombic, tetragonal, and cubic phases of methylammonium lead iodide F Brivio, JM Frost, JM Skelton, AJ Jackson, OJ Weber, MT Weller, AR Goni, ...
Physical Review B 92 (14), 144308, 2015
585 2015 sumo: Command-line tools for plotting and analysis of periodic* ab initio* calculations AM Ganose, AJ Jackson, DO Scanlon
Journal of Open Source Software 3 (28), 717, 2018
363 2018 Lattice dynamics of the tin sulphides SnS 2, SnS and Sn 2 S 3: vibrational spectra and thermal transport JM Skelton, LA Burton, AJ Jackson, F Oba, SC Parker, A Walsh
Physical Chemistry Chemical Physics 19 (19), 12452-12465, 2017
241 2017 Computational screening of all stoichiometric inorganic materials DW Davies, KT Butler, AJ Jackson, A Morris, JM Frost, JM Skelton, ...
Chem 1 (4), 617-627, 2016
167 2016 Vibrational spectra and lattice thermal conductivity of kesterite-structured Cu2ZnSnS4 and Cu2ZnSnSe4 JM Skelton, AJ Jackson, M Dimitrievska, SK Wallace, A Walsh
Apl Materials 3 (4), 2015
88 2015 Dielectric response of Fe2O3 crystals and thin films RA Lunt, AJ Jackson, A Walsh
Chemical physics letters 586, 67-69, 2013
70 2013 Limits to doping of wide band gap semiconductors A Walsh, J Buckeridge, CRA Catlow, AJ Jackson, TW Keal, M Miskufova, ...
Chemistry of Materials 25 (15), 2924-2926, 2013
68 2013 A universal chemical potential for sulfur vapours AJ Jackson, D Tiana, A Walsh
Chemical science 7 (2), 1082-1092, 2016
64 2016 Ab initio thermodynamic model of Cu 2 ZnSnS 4 AJ Jackson, A Walsh
Journal of Materials Chemistry A 2 (21), 7829-7836, 2014
58 2014 Galore: Broadening and weighting for simulation of photoelectron spectroscopy A J Jackson, A M Ganose, A Regoutz, R G Egdell, O D Scanlon
Journal of Open Source Software 3 (26), 2018
45 2018 Resonant Raman scattering of ZnS x Se 1− x solid solutions: the role of S and Se electronic states M Dimitrievska, H Xie, AJ Jackson, X Fontané, M Espíndola-Rodríguez, ...
Physical Chemistry Chemical Physics 18 (11), 7632-7640, 2016
42 2016 Smact: Semiconducting materials by analogy and chemical theory DW Davies, KT Butler, AJ Jackson, JM Skelton, K Morita, A Walsh
Journal of Open Source Software 4 (38), 1361, 2019
39 2019 Oxidation of GaN: An ab initio thermodynamic approach AJ Jackson, A Walsh
Physical Review B—Condensed Matter and Materials Physics 88 (16), 165201, 2013
32 2013 Crystal structure optimisation using an auxiliary equation of state AJ Jackson, JM Skelton, CH Hendon, KT Butler, A Walsh
The Journal of Chemical Physics 143 (18), 2015
23 2015 Automated bonding analysis with crystal orbital hamilton populations J George, G Petretto, A Naik, M Esters, AJ Jackson, R Nelson, ...
ChemPlusChem 87 (11), e202200123, 2022
21 2022 Suppression of lattice thermal conductivity by mass-conserving cation mutation in multi-component semiconductors T Shibuya, JM Skelton, AJ Jackson, K Yasuoka, A Togo, I Tanaka, ...
APL Materials 4 (10), 2016
18 2016 Band edge evolution of transparent MJ Wahila, ZW Lebens-Higgins, AJ Jackson, DO Scanlon, TL Lee, ...
Physical Review B 100 (8), 085126, 2019
14 2019 Euphonic: inelastic neutron scattering simulations from force constants and visualization tools for phonon properties R Fair, A Jackson, D Voneshen, D Jochym, D Le, K Refson, T Perring
Journal of Applied Crystallography 55 (6), 1689-1703, 2022
11 2022 Computational Prediction and Experimental Realization of Earth-Abundant Transparent Conducting Oxide Ga-Doped ZnSb2 O6 AJ Jackson, BJ Parrett, J Willis, AM Ganose, WWW Leung, Y Liu, ...
ACS Energy Letters 7 (11), 3807-3816, 2022
10 2022 Experimental and computational studies of sulfided NiMo supported on pillared clay: catalyst activation and guaiacol adsorption sites F Oemry, IB Adilina, WT Cahyanto, N Rinaldi, F Aulia, A Jackson, ...
Physical Chemistry Chemical Physics 25 (4), 2978-2989, 2023
2023 
Aron WalshDepartment of Materials, Imperial College LondonBestätigte E-Mail-Adresse bei imperial.ac.uk
