| Beyond methylammonium lead iodide: prospects for the emergent field of ns 2 containing solar absorbers AM Ganose, CN Savory, DO Scanlon Chemical Communications 53 (1), 20-44, 2017 | 342 | 2017 |
| Defect tolerance to intolerance in the vacancy-ordered double perovskite semiconductors Cs2SnI6 and Cs2TeI6 AE Maughan, AM Ganose, MM Bordelon, EM Miller, DO Scanlon, ... Journal of the American Chemical Society, 2016 | 319 | 2016 |
| Interplay of orbital and relativistic effects in bismuth oxyhalides: BiOF, BiOCl, BiOBr, and BiOI AM Ganose, M Cuff, KT Butler, A Walsh, DO Scanlon Chemistry of Materials 28 (7), 1980-1984, 2016 | 243 | 2016 |
| Band gap and work function tailoring of SnO2 for improved transparent conducting ability in photovoltaics AM Ganose, DO Scanlon Journal of Materials Chemistry C, 2016 | 189 | 2016 |
| 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 | 166 | 2018 |
| Relativistic electronic structure and band alignment of BiSI and BiSeI: candidate photovoltaic materials AM Ganose, KT Butler, A Walsh, DO Scanlon Journal of Materials Chemistry A 4 (6), 2060-2068, 2016 | 122 | 2016 |
| (CH3NH3)2Pb(SCN)2I2: A More Stable Structural Motif for Hybrid Halide Photovoltaics? A Ganose, CN Savory, DO Scanlon The Journal of Physical Chemistry Letters 6, 4594--4598, 2015 | 118 | 2015 |
| Perspectives and design principles of vacancy-ordered double perovskite halide semiconductors AE Maughan, AM Ganose, DO Scanlon, JR Neilson Chemistry of Materials 31 (4), 1184-1195, 2019 | 99 | 2019 |
| Anharmonicity and octahedral tilting in hybrid vacancy-ordered double perovskites AE Maughan, AM Ganose, AM Candia, JT Granger, DO Scanlon, ... Chemistry of Materials 30 (2), 472-483, 2018 | 76 | 2018 |
| Tolerance factor and cooperative tilting effects in vacancy-ordered double perovskite halides AE Maughan, AM Ganose, MA Almaker, DO Scanlon, JR Neilson Chemistry of Materials 30 (11), 3909-3919, 2018 | 73 | 2018 |
| Exploiting excited-state aromaticity to design highly stable singlet fission materials KJ Fallon, P Budden, E Salvadori, AM Ganose, CN Savory, L Eyre, ... Journal of the American Chemical Society 141 (35), 13867-13876, 2019 | 72 | 2019 |
| Stability of the M2 phase of vanadium dioxide induced by coherent epitaxial strain NF Quackenbush, H Paik, MJ Wahila, S Sallis, ME Holtz, X Huang, ... Physical Review B 94 (8), 085105, 2016 | 72 | 2016 |
| Efficient calculation of carrier scattering rates from first principles AM Ganose, J Park, A Faghaninia, R Woods-Robinson, KA Persson, ... Nature Communications 12 (1), 1-9, 2021 | 68 | 2021 |
| Benchmarking materials property prediction methods: the matbench test set and automatminer reference algorithm A Dunn, Q Wang, A Ganose, D Dopp, A Jain npj Computational Materials 6 (1), 1-10, 2020 | 67 | 2020 |
| Probing the chemical structure of monolayer covalent-organic frameworks grown via Schiff-base condensation reactions Y Hu, N Goodeal, Y Chen, AM Ganose, RG Palgrave, H Bronstein, ... Chemical Communications 52 (64), 9941-9944, 2016 | 61 | 2016 |
| First-principles insights into tin-based two-dimensional hybrid halide perovskites for photovoltaics Z Wang, AM Ganose, C Niu, DO Scanlon Journal of Materials Chemistry A 6 (14), 5652-5660, 2018 | 55 | 2018 |
| Antiferromagnetism at T> 500 K in the layered hexagonal ruthenate SrRu2O6 CI Hiley, DO Scanlon, AA Sokol, SM Woodley, AM Ganose, S Sangiao, ... Physical Review B 92 (10), 104413, 2015 | 50 | 2015 |
| Defect engineering of earth-abundant solar absorbers BiSI and BiSeI AM Ganose, S Matsumoto, J Buckeridge, DO Scanlon Chemistry of Materials 30 (11), 3827-3835, 2018 | 49 | 2018 |
| Narrow-band anisotropic electronic structure of D Biswas, AM Ganose, R Yano, JM Riley, L Bawden, OJ Clark, J Feng, ... Physical Review B 96 (8), 085205, 2017 | 47 | 2017 |
| Anion Distribution, Structural Distortion, and Symmetry-Driven Optical Band Gap Bowing in Mixed Halide Cs2SnX6 Vacancy Ordered Double Perovskites MMS Karim, AM Ganose, L Pieters, WW Winnie Leung, J Wade, L Zhang, ... Chemistry of Materials 31 (22), 9430-9444, 2019 | 43 | 2019 |
David ScanlonProfessor of Computational Materials Design at University College LondonVerified email at ucl.ac.uk
