http://kitchingroup.cheme.cmu.edu [email protected]
Carnegie Mellon University Pittsburgh, PA I am a Professor of Chemical Engineering.
John Kitchin
A book on modeling materials using VASP, ase and vasp
jkitchin
New version of dft-book for Quantum Espresso
Course repository for 06-640 - Molecular simulation
Dynamic modules for emacs
An emacs starterkit for scientists and engineers
Fall 2018 - Mathematical Modeling of Chemical Engineering Processes
python enhancements of ase.calculators.vasp
Johns customizations to maximize emacs
+cmu matlab package for units and other useful things.