Keith Tobias Butler

机构: Department of Chemistry, University College London

主页: mdi-group.github.io

每年引用次数

引用次数

引用: 13,669

H-指数: 47

I10-指数 : 98

出版物: 322

标题

引用次数

年份

A computational investigation of nickel (silicides) as potential contact layers for silicon photovoltaic cells

Keith T Butler , John H Harding
Journal of Physics: Condensed Matter 25 ( 39) 395003 -395003

2013

Quick-start guide for first-principles modelling of semiconductor interfaces

Ji-Sang Park , Young-Kwang Jung , Keith T Butler , Aron Walsh
Journal of Physics: Energy 1 ( 1) 016001

2018

Understanding dynamic properties of materials using neutron spectroscopy and atomistic simulation

Jeff Armstrong , Alexander J O’Malley , Matthew R Ryder , Keith T Butler
Journal of Physics Communications 4 ( 7) 072001

2020

Computers in neutron science

Jeff Armstrong , Keith T Butler , Matthew R Ryder ,
Journal of Physics Communications 4 ( 11) 110401

2020

Origin of ferroelectricity in two prototypical hybrid organic--inorganic perovskites

Kai Li , Zhi-Gang Li , Jun Xu , Yan Qin
Journal of the American Chemical Society 144 ( 2) 816 -823

2022

Hydrogen bonding versus entropy: revealing the underlying thermodynamics of the hybrid organic--inorganic perovskite [CH3NH3] PbBr3

Gregor Kieslich , Jonathan Michael Skelton , Jeff Armstrong , Yue Wu
Chemistry of Materials 30 ( 24) 8782 -8788

2018

Crystal-structure Optimisation Exploiting the Similarity of Equations-of-state Across Exchange-correlation Functionals:∆ Vxc

Adam J Jackson , Jonathan M Skelton , Christopher H Hendon , Keith T Butler
Smpte Journal

Vibrational Entropy Driven Unusual Phase Transition in A Hybrid Organic-Inorganic Perovskite

Wenjuan Wei , Wei Li , Keith T Butler , Guoqiang Feng
Angewandte Chemie-International Edition 57 ( 29) 8932 -8936

Mixed-anion mixed-cation perovskite (FAPbI 3) 0.875 (MAPbBr 3) 0.125: an ab initio molecular dynamics study

Eduardo Menéndez-Proupin , Shivani Grover , Ana L Montero-Alejo , Scott D Midgley
Journal of Materials Chemistry A 10 ( 17) 9592 -9603

2022

Interpretable and explainable machine learning for materials science and chemistry

Felipe Oviedo , Juan Lavista Ferres , Tonio Buonassisi , Keith T Butler
Accounts of Materials Research 3 ( 6) 597 -607

2022

Ultralow work function of the electride Sr 3 CrN 3

Cuicui Wang , Miaoting Xu , Keith T Butler , Lee A Burton
Physical Chemistry Chemical Physics 24 ( 15) 8854 -8858

2022

Entropy-based active learning of graph neural network surrogate models for materials properties

Johannes Allotey , Keith T Butler , Jeyan Thiyagalingam ,
The Journal of Chemical Physics 155 ( 17)

2021

Co-Substituted BiFeO3: Electronic, Ferroelectric, and Thermodynamic Properties from First Principles

Shivani Grover , Keith T Butler , Umesh V Waghmare , Ricardo Grau‐Crespo
Advanced Theory and Simulations 6 ( 10) 2200673

2023

Design of New Ternary Nitrides for Photovoltaic Applications via High-Throughput Calculations

Pengyan Xue , Dongdong Chu , Congwei Xie , Evgenii Tikhonov
The Journal of Physical Chemistry C 126 ( 40) 17398 -17405

2022

Relativistic quasiparticle self-consistent electronic structure of hybrid halide

Federico Brivio , Keith T Butler , Aron Walsh , Mark van Schilfgaarde
Solar cells 7

2014

SCHEDULED MAINTENANCE Close the message box

Thomas D Bennett , Alain H Fuchs , Anthony K Cheetham , François-Xavier Coudert
Dalton Trans 45 4058 -4059

2016

Chemical Communications c5cc06190c

Gregor Kieslich , Shohei Kumagai , Keith T Butler , Takuro Okamura

Daniel W Davies , Keith T Butler , Olexandr Isayev , Aron Walsh

Dynamic disorder induced memristance in amorphous solids

Christopher N Singh , Keith T Butler , Allan H MacDonald , Louis FJ Piper
arXiv preprint arXiv:1908.08070

2019

Co-Substituted BiFeO

Shivani Grover , Keith T Butler , Umesh V Waghmare , Ricardo Grau-Crespo

2022

Machine Learning

Materials Science

Energy Materials

Interfaces

Keith Tobias Butler

引用次数

出版物: 322

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