| Report on the sixth blind test of organic crystal structure prediction methods AM Reilly, RI Cooper, CS Adjiman, S Bhattacharya, AD Boese, ... Acta Crystallographica Section B: Structural Science, Crystal Engineering …, 2016 | 612 | 2016 |
| Anharmonic vibrational properties in periodic systems: energy, electron-phonon coupling, and stress B Monserrat, ND Drummond, RJ Needs Physical Review B 87 (14), 144302, 2013 | 216 | 2013 |
| Dissociation of high-pressure solid molecular hydrogen: A quantum Monte Carlo and anharmonic vibrational study S Azadi, B Monserrat, WMC Foulkes, RJ Needs Physical review letters 112 (16), 165501, 2014 | 166 | 2014 |
| Lattice dynamics and electron-phonon coupling calculations using nondiagonal supercells JH Lloyd-Williams, B Monserrat Physical Review B 92 (18), 184301, 2015 | 163 | 2015 |
| Highly Efficient Blue‐Emitting CsPbBr3 Perovskite Nanocrystals through Neodymium Doping Y Xie, B Peng, I Bravić, Y Yu, Y Dong, R Liang, Q Ou, B Monserrat, ... Advanced Science 7 (20), 2001698, 2020 | 152 | 2020 |
| Temperature dependence of the energy levels of methylammonium lead iodide perovskite from first-principles WA Saidi, S Poncé, B Monserrat The journal of physical chemistry letters 7 (24), 5247-5252, 2016 | 129 | 2016 |
| Long-range ballistic propagation of carriers in methylammonium lead iodide perovskite thin films J Sung, C Schnedermann, L Ni, A Sadhanala, RYS Chen, C Cho, L Priest, ... Nature Physics 16 (2), 171-176, 2020 | 123 | 2020 |
| Quantum Monte Carlo study of the phase diagram of solid molecular hydrogen at extreme pressures ND Drummond, B Monserrat, JH Lloyd-Williams, PL Ríos, CJ Pickard, ... Nature communications 6 (1), 7794, 2015 | 109 | 2015 |
| Comparing electron-phonon coupling strength in diamond, silicon, and silicon carbide: First-principles study B Monserrat, RJ Needs Physical Review B 89 (21), 214304, 2014 | 100 | 2014 |
| Electron–phonon coupling from finite differences B Monserrat Journal of Physics: Condensed Matter 30 (8), 083001, 2018 | 92 | 2018 |
| Correlation effects on electron-phonon coupling in semiconductors: Many-body theory along thermal lines B Monserrat Physical Review B 93 (10), 100301, 2016 | 84 | 2016 |
| Electron-phonon coupling and the metallization of solid helium at terapascal pressures B Monserrat, ND Drummond, CJ Pickard, RJ Needs Physical review letters 112 (5), 055504, 2014 | 84 | 2014 |
| Vibrational averages along thermal lines B Monserrat Physical Review B 93 (1), 014302, 2016 | 81 | 2016 |
| Liquid water contains the building blocks of diverse ice phases B Monserrat, JG Brandenburg, EA Engel, B Cheng Nature communications 11 (1), 5757, 2020 | 78 | 2020 |
| Temperature effects in the band structure of topological insulators B Monserrat, D Vanderbilt Physical review letters 117 (22), 226801, 2016 | 77 | 2016 |
| Role of electron–phonon coupling in the thermal evolution of bulk rashba-like spin-split lead halide perovskites exhibiting dual-band photoluminescence JA Steele, P Puech, B Monserrat, B Wu, RX Yang, T Kirchartz, H Yuan, ... ACS energy letters 4 (9), 2205-2212, 2019 | 76 | 2019 |
| Structure and metallicity of phase V of hydrogen B Monserrat, ND Drummond, P Dalladay-Simpson, RT Howie, ... Physical Review Letters 120 (25), 255701, 2018 | 76 | 2018 |
| Phonons as a platform for non-Abelian braiding and its manifestation in layered silicates B Peng, A Bouhon, B Monserrat, RJ Slager Nature Communications 13 (1), 423, 2022 | 73* | 2022 |
| Defect identification based on first-principles calculations for deep level transient spectroscopy D Wickramaratne, CE Dreyer, B Monserrat, JX Shen, JL Lyons, ... Applied Physics Letters 113 (19), 192106, 2018 | 73 | 2018 |
| Anharmonic nuclear motion and the relative stability of hexagonal and cubic ice EA Engel, B Monserrat, RJ Needs Physical Review X 5 (2), 021033, 2015 | 70 | 2015 |
Chris J. PickardSir Alan Cottrell Professor of Materials Science, University of CambridgeVerified email at cam.ac.uk
