AiiDA is a workflow manager for computational science with a strong focus on provenance, performance and extensibility.
A module to obtain and visualize k-vector coefficients and obtain band paths in the Brillouin zone of crystal structures
The official AiiDA plugin for Quantum ESPRESSO
A Python workflow library.
The official AiiDA plugin for ASE.
The Official AiiDA plugin for the cod-tools package.
Robust, high-volume, message based communication made easy.
Connect to an existing PostgreSQL cluster as a postgres superuser and execute SQL commands.
The official AiiDA plugin for NWChem
A set of useful tools to manage Quantum ESPRESSO files.
Advanced AiiDA workflows for Wannier90
AiiDA demo plugin that wraps the `diff` executable for computing the difference between two files.
AiiDA: an automated interactive infrastructure and database for computational science
A base scaffolding to create online web tools
An implementation of an efficient object store writing directly into a disk folder
Export archives for migration tests for AiiDA
AiiDA Plugin for the Wannier90 code
A port proxy for JupyterHub when using the DockerSpawner, optionally with (token-based) authorization.