scientific
Best practice and tips & tricks to write scientific papers in LaTeX, with figures generated in Python or Matlab.
Matplotlib styles for scientific plotting
Zotero plugin for auto-fetching numbers of citations from Google Scholar
A userscript to insert citations from Zotero into ShareLaTeX as you write
Make Zotero effective for us LaTeX holdouts
The program allows you to create regular structure supercell from cif file with partial occupancy and/or substitutions.
atomate2 is a library of computational materials science workflows
Jupyter notebooks and data for our Chemistry of Materials article "Data-driven First Principles Methods for the Study and Design of Alkali Superionic Conductors"
A collection of LaTeX templates in English/Chinese, with VS Code settings for LaTeX Workshop.
Cleanthesis LaTeX template following Sorbonne Université rules
MACE foundation models (MP, OMAT, Matpes)
Python implementation of the string method to compute the minimum energy path between two points on any 2-dimensional energy landscape.