Pinned Repositories
abTEM
ab initio Transmission Electron Microscopy
FitSNAP
Software for generating SNAP machine-learning interatomic potentials
json
JSON for Modern C++
qball
Qball (also known as qb@ll) is a first-principles molecular dynamics code that is used to compute the electronic structure of atoms, molecules, solids, and liquids within the Density Functional Theory (DFT) formalism. It is a fork of the Qbox code by Francois Gygi.
vasp_tools
Various tools for VASP
USER-EPH
LAMMPS extension to capture electron-ion interaction. This is a mirror of https://gitlab.com/artuuuro/USER-EPH.
artuuuro's Repositories
artuuuro/vasp_tools
Various tools for VASP
artuuuro/abTEM
ab initio Transmission Electron Microscopy
artuuuro/FitSNAP
Software for generating SNAP machine-learning interatomic potentials
artuuuro/json
JSON for Modern C++
artuuuro/qball
Qball (also known as qb@ll) is a first-principles molecular dynamics code that is used to compute the electronic structure of atoms, molecules, solids, and liquids within the Density Functional Theory (DFT) formalism. It is a fork of the Qbox code by Francois Gygi.