555 citations · 1.1k across the 3 of their papers we have counts for
7 papers
Effects of Grain Boundaries and Surfaces on Electronic and Mechanical Properties of Solid Electrolytes
Weihang Xie, Zeyu Deng, Zhengyu Liu +3
Extended defects, including exposed surfaces and grain boundaries, are critical to the properties of polycrystalline solid electrolytes in all-solid-state batteries (ASSBs). These…
Element similarity in high-dimensional materials representations
Anthony Onwuli, Ashish V. Hegde, Kevin Nguyen +2
The traditional display of elements in the periodic table is convenient for the study of chemistry and physics. However, the atomic number alone is insufficient for training statis…
Versatile Domain Mapping Of Scanning Electron Nanobeam Diffraction Datasets Utilising Variational AutoEncoders and Decoder-Assisted Latent-Space Clustering
Andy Bridger, William I. F. David, Thomas J. Wood +2
Advancements in fast electron detectors have enabled the statistically significant sampling of crystal structures on the nanometre scale by means of Scanning Electron Nanobeam Diff…
Mixed-anion mixed-cation perovskite (FAPbI)(MAPbBr): an ab-initio molecular dynamics study
Eduardo Menéndez-Proupin, Shivani Grover, Ana L. Montero-Alejo +3
Mixed-anion mixed-cation perovskites with (FAPbI)(MAPbBr) composition have allowed record efficiencies in photovoltaic solar cells, but their atomic-scale behav…
Microscopic origin of entropy-driven polymorphism in hybrid organic-inorganic perovskite materials
Keith T. Butler, Gregor Kieslich, Katrine Svane +2
Entropy is a critical, but often overlooked, factor in determining the relative stabilities of crystal phases. The importance of entropy is most pronounced in softer materials, whe…
Ferroelectric Materials for Solar Energy Conversion: Photoferroics Revisited
Keith T. Butler, Jarvist M. Frost, Aron Walsh
The application of ferroelectric materials (i.e. solids that exhibit spontaneous electric polarisation) in solar cells has a long and controversial history. This includes the first…