AiiDA plugin that makes running shell commands easy.
☆16Aug 26, 2026Updated this week
Alternatives and similar repositories for aiida-shell
Users that are interested in aiida-shell are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Some classes to help managing large number of submissions, while controlling the maximum number of submissions running at any given time☆10Jul 20, 2026Updated last month
- An AiiDA plugin for dynamically defining workflows using Python functions☆19Jun 10, 2022Updated 4 years ago
- The official AiiDA plugin for Phonopy☆24Aug 17, 2026Updated 2 weeks ago
- Efficiently design and manage flexible workflows with AiiDA, featuring an interactive GUI, checkpoints, provenance tracking, and remote e…☆30Updated this week
- AiiDA plugin for the Wannier90 code☆12May 10, 2024Updated 2 years ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- AiiDAlab App for Quantum ESPRESSO☆33Aug 19, 2026Updated last week
- A collection of advanced automated workflows to compute Wannier functions using AiiDA and the Wannier90 code☆24Aug 20, 2026Updated last week
- A repository for the implementation of common workflow interfaces across materials-science codes and plugins☆60Jun 26, 2026Updated 2 months ago
- The CP2K plugin for the AiiDA workflow and provenance engine.☆25Aug 11, 2026Updated 2 weeks ago
- The official AiiDA plugin for Quantum ESPRESSO☆90Aug 14, 2026Updated 2 weeks ago
- Find plugins for AiiDA☆21Updated this week
- AiiDA Web API for data queries and workflow management.☆11Aug 5, 2026Updated 3 weeks ago
- Python Workflow Definition - workflow interoperability for aiida, jobflow and pyiron☆19Updated this week
- A widget to visualize and edit atomic structures in Jupyter Notebook☆49Feb 20, 2026Updated 6 months ago
- Proton VPN Special Offer - Get 70% off • AdSpecial partner offer. Trusted by over 100 million users worldwide. Tested, Approved and Recommended by Experts.
- A Julia package for fitting the equation of state of solids, and more☆16Jun 18, 2026Updated 2 months ago
- LAMMPS plugin for AiiDA☆28Aug 24, 2026Updated last week
- A Julia wrapper for the spglib C-API☆24Jun 22, 2026Updated 2 months ago
- AiiDA plugin for Gaussian quantum chemistry software☆12Feb 21, 2026Updated 6 months ago
- A plugin to AiiDA for running simulations with VASP☆64Updated this week
- Post-processing toolkit for electronic structure calculations☆18Jul 1, 2026Updated last month
- machine learning interatomic potentials aiida plugin☆26Updated this week
- AiiDA plugin of the high-performance density functional theory code FLEUR (www.judft.de) for high-throughput electronic structure calcula…☆15Updated this week
- Implementation of Koopmans-compliant functionals in Quantum ESPRESSO☆17Jul 9, 2026Updated last month
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- WEAS is JavaScript library to visualize and manipulate the atomic structures directly in the web browser.☆15Jul 31, 2026Updated last month
- The official repository for the AiiDA code☆579Updated this week
- A set of utilities and pedagogic notebooks for the use of linear and kernel methods in atomistic modeling☆26Oct 27, 2023Updated 2 years ago
- Create beegfs server and client☆23Dec 2, 2021Updated 4 years ago
- Material of the seminar "Julia for Materials Modelling"☆30Jun 23, 2023Updated 3 years ago
- AiiDA plugin for the Python-based Simulations of Chemistry Framework (PySCF)☆25Nov 29, 2024Updated last year
- Basic Python libraries used by UGent's HPC group☆15Feb 24, 2026Updated 6 months ago
- AiiDA tutorials web site☆24Oct 2, 2025Updated 10 months ago
- QE-GIPAW for Quantum-Espresso (official repository)☆40Jul 18, 2026Updated last month
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- Dashboard to explore CoRE MOF database☆13Jul 5, 2020Updated 6 years ago
- The RASPA plugin for the AiiDA workflow and provenance engine. http://www.aiida.net☆13Aug 27, 2023Updated 3 years ago
- Install script collection for open-source software☆14Jul 10, 2026Updated last month
- BET Surface Identification - a program that fully implements the rouquerol criteria☆17Jul 6, 2023Updated 3 years ago
- The recursive hybrid tetrathedron method for Brillouin zone integrations in 2D/3D☆11Nov 20, 2021Updated 4 years ago
- An offline corepresentation database and tool set for 1651 magnetic space groups.☆14Mar 23, 2023Updated 3 years ago
- A playground for Wannier functions☆43Aug 22, 2026Updated last week