gitlab.com / espeem
espeem/public/CalcTroll
CalcTroll is designed for keeping track of atomic-scale materials calculations.
Last synced at: over 2 years ago - Stars: 2 - Forks: 3
espeem/public/PyVAFM
This a mirror site of the project, PyVAFM (documentation at http://singroup.github.io/PyVAFM)
Last synced at: over 2 years ago - Stars: 0 - Forks: 0
espeem/public/atomic-scale-simulation-environments
This repo is dedicated to setting up simulation environments for atomic-scale simulation software. These types of software often contain complex dependencies and are difficult to build correctly. Hence this repo sharing best practices.
Last synced at: over 2 years ago - Stars: 0 - Forks: 0
espeem/public/ase
A Python library for working with atoms
Last synced at: over 2 years ago - Stars: 0 - Forks: 0
