2 Repositories
Python ase Libraries
Python module for drawing and rendering beautiful atoms and molecules using Blender.
Batoms is a Python package for editing and rendering atoms and molecules objects using blender. A Python interface that allows for automating workflows.
1 Jul 6, 2022
Automation of VASP DFT workflows with ASE - application scripts
This repo contains a library that aims at automatizing some Density Functional Theory (DFT) workflows in VASP by using the ASE toolkit.
5 Sep 6, 2022