27 projects
aiidalab-qe-vibroscopy
AiiDAlab QE plugin for vibrational spectroscopies.
aiida-core
AiiDA is a workflow manager for computational science with a strong focus on provenance, performance and extensibility.
seekpath
A module to obtain and visualize k-vector coefficients and obtain band paths in the Brillouin zone of crystal structures
aiida-quantumespresso
The official AiiDA plugin for Quantum ESPRESSO
aiida-shell
AiiDA plugin that makes running shell commands easy.
plumpy
A Python workflow library.
pytp357s
Fetch and visualize history from ThermoPro TP357S BLE temperature/humidity sensors
qe-tools
None
jupyterlab-hide-code
A button in JupyterLab to run the code cells and then to hide the code cells.
aiida-wannier90-workflows
Advanced AiiDA workflows for Wannier90
disk_objectstore
An implementation of an efficient object store that writes directly on disk.
scwidgets
A collection of widgets to prepare interactive scientific visualisations, including user code input and validation
kiwipy
Robust, high-volume, message based communication made easy.
big-map-archive-api-client
A CLI app to interact with BIG-MAP Archive data repositories
pgsu
Connect to an existing PostgreSQL cluster as the `postgres` superuser and execute SQL commands.
aiida-wannier90
AiiDA Plugin for the Wannier90 code
aiida-sssp-workflow
Package for the AiiDA SSSP workflow
aiida-ase
The official AiiDA plugin for ASE.
aiida-common-workflows
Package that defines common interfaces for workflows that are implemented in AiiDA for various quantum engines.
aiida-nwchem
The official AiiDA plugin for NWChem
aiida-s3
AiiDA plugin that provides a storage backend using an S3 object store as the file repository.
aiida-codtools
The Official AiiDA plugin for the cod-tools package.
aiida-diff
AiiDA demo plugin that wraps the `diff` executable for computing the difference between two files.
aiida
AiiDA: an automated interactive infrastructure and database for computational science
tools-barebone
A base scaffolding to create online web tools
aiida-export-migration-tests
Export archives for migration tests for AiiDA
jhproxy
A port proxy for JupyterHub when using the DockerSpawner, optionally with (token-based) authorization.