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Name: Keith Butler
Type: User
Name: Keith Butler
Type: User
Analyse electron density & potential grids using Python
Animations of phonon modes associated with the paper "Low frequency vibrations and highly disordered molecules: The importance of entropy for phase stability in the hybrid perovskite [CH$_3$NH$_3$]PbBr$_3$, revealed by inelastic neutron scattering and \textit{ab initio} lattice dynamics"
A beautiful, simple, clean, and responsive Jekyll theme for academics
Python implementation of the Mixed-Scale Dense Convolutional Neural Network
Converts the output in the Phonopy mesh.conf file to input for a-climax, for calculating inelastic neutron scattering spectra
Python script for plotting VASP DOS layer by layer.
An example of the quantum harmonic oscillator for the Advanced Nanocomposites course
Uses the SeeKpath program and the ASE package to generate standardised sets of special points and paths between them for any given crystal structure.
Distributed representations of atoms, inspired by the Skip-gram model
Tools required to calculate the SLME of materials
Surface Optimisation for Deposition on Materials
A PyTorch-based Speech Toolkit
Splitting VASP tajectory XDATCAR to multiple POSCARs at as many points as required.
This repo is for demonstration purposes only.
Code related to the `Artificial intelligence for reconstruction and super-resolution of chemical tomography` project
Spreadsheet for generating 3 component Tersoff potential input for Lammps
Extracts full elastic tensor from VASP OUTCAR and calculates some useful quantities
A shell script for calculating many interesting materials' parameters for photovoltaic applications, includng Band gap, polarisation
Building surface slabs for VASP
A declarative, efficient, and flexible JavaScript library for building user interfaces.
🖖 Vue.js is a progressive, incrementally-adoptable JavaScript framework for building UI on the web.
TypeScript is a superset of JavaScript that compiles to clean JavaScript output.
An Open Source Machine Learning Framework for Everyone
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Bring data to life with SVG, Canvas and HTML. 📊📈🎉
JavaScript (JS) is a lightweight interpreted programming language with first-class functions.
Some thing interesting about web. New door for the world.
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Some thing interesting about visualization, use data art
Some thing interesting about game, make everyone happy.
We are working to build community through open source technology. NB: members must have two-factor auth.
Open source projects and samples from Microsoft.
Google ❤️ Open Source for everyone.
Alibaba Open Source for everyone
Data-Driven Documents codes.
China tencent open source team.