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 |
Dynamic disorder, phonon lifetimes, and the assignment of modes to the vibrational spectra of methylammonium lead halide perovskites AMA Leguy, AR Goñi, JM Frost, J Skelton, F Brivio, X Rodríguez-Martínez, ... Physical Chemistry Chemical Physics 18 (39), 27051-27066, 2016 | 397 | 2016 |
Metallic Conductivity in a Two-Dimensional Cobalt Dithiolene Metal–Organic Framework AJ Clough, JM Skelton, CA Downes, AA de la Rosa, JW Yoo, A Walsh, ... Journal of the American Chemical Society 139 (31), 10863-10867, 2017 | 329 | 2017 |
Electronic and optical properties of single crystal SnS 2: an earth-abundant disulfide photocatalyst LA Burton, TJ Whittles, D Hesp, WM Linhart, JM Skelton, B Hou, ... Journal of Materials Chemistry A 4 (4), 1312-1318, 2016 | 301 | 2016 |
Direct Observation of Dynamic Symmetry Breaking above Room Temperature in Methylammonium Lead Iodide Perovskite AN Beecher, OE Semonin, JM Skelton, JM Frost, MW Terban, H Zhai, ... ACS Energy Letters 1 (4), 880-887, 2016 | 274 | 2016 |
Thermal physics of the lead chalcogenides PbS, PbSe, and PbTe from first principles JM Skelton, SC Parker, A Togo, I Tanaka, A Walsh Physical Review B 89, 205203, 2014 | 266 | 2014 |
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 | 240 | 2017 |
Spontaneous Octahedral Tilting in the Cubic Inorganic Cesium Halide Perovskites CsSnX3 and CsPbX3 (X = F, Cl, Br, I) RX Yang, JM Skelton, EL da Silva, JM Frost, A Walsh The Journal of Physical Chemistry Letters 8 (19), 4720-4726, 2017 | 220 | 2017 |
Band Alignments, Valence Bands, and Core Levels in the Tin Sulfides SnS, SnS2, and Sn2S3: Experiment and Theory TJ Whittles, LA Burton, JM Skelton, A Walsh, TD Veal, VR Dhanak Chemistry of Materials 28 (11), 3718-3726, 2016 | 218 | 2016 |
Anharmonicity in the High-Temperature Phase of SnSe: Soft Modes and Three-Phonon Interactions JM Skelton, LA Burton, SC Parker, A Walsh, CE Kim, A Soon, ... Physical Review Letters 117 (7), 075502, 2016 | 197 | 2016 |
Phase stability and transformations in the halide perovskite CsSnI 3 EL da Silva, JM Skelton, SC Parker, A Walsh Physical Review B 91 (14), 144107, 2015 | 188 | 2015 |
Phonon anharmonicity, lifetimes, and thermal transport in CH 3 NH 3 PbI 3 from many-body perturbation theory LD Whalley, JM Skelton, JM Frost, A Walsh Physical Review B 94 (22), 220301, 2016 | 166 | 2016 |
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 | 163 | 2016 |
Computational materials design of crystalline solids KT Butler, JM Frost, JM Skelton, KL Svane, A Walsh Chemical Society Reviews 45 (22), 6138-6146, 2016 | 128 | 2016 |
Room Temperature Metallic Conductivity in a Metal–Organic Framework Induced by Oxidation AJ Clough, NM Orchanian, JM Skelton, AJ Neer, SA Howard, CA Downes, ... Journal of the American Chemical Society 141 (41), 16323-16330, 2019 | 107 | 2019 |
Influence of the exchange-correlation functional on the quasi-harmonic lattice dynamics of II-VI semiconductors JM Skelton, D Tiana, SC Parker, A Togo, I Tanaka, A Walsh The Journal of chemical physics 143 (6), 2015 | 107 | 2015 |
Influence of the exchange-correlation functional on the quasi-harmonic lattice dynamics of II-VI semiconductors JM Skelton, D Tiana, SC Parker, A Togo, I Tanaka, A Walsh The Journal of chemical physics 143 (6), 2015 | 107 | 2015 |
Acoustic phonon lifetimes limit thermal transport in methylammonium lead iodide A Gold-Parker, PM Gehring, JM Skelton, IC Smith, D Parshall, JM Frost, ... Proceedings of the National Academy of Sciences 115 (47), 11905-11910, 2018 | 106 | 2018 |
Understanding magnetic relaxation in single-ion magnets with high blocking temperature A Chiesa, F Cugini, R Hussain, E Macaluso, G Allodi, E Garlatti, ... Physical Review B 101 (17), 174402, 2020 | 105 | 2020 |
Chemical and Lattice Stability of the Tin Sulfides JM Skelton, LA Burton, F Oba, A Walsh The Journal of Physical Chemistry C 121 (12), 6446-6454, 2017 | 92 | 2017 |