AiiDA Web API for data queries and workflow management.
☆12Feb 11, 2026Updated 2 months ago
Alternatives and similar repositories for aiida-restapi
Users that are interested in aiida-restapi are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- A quick tutorial for modern materials science, should the reader be not familiar with it and just wishing to crack the data☆16Aug 24, 2025Updated 7 months ago
- LAMMPS plugin for AiiDA☆28Updated this week
- Curated list of known efforts in collecting and/or curating of chemical/materials data☆23Dec 8, 2020Updated 5 years ago
- Specification of a common REST API for access to materials databases☆104Feb 6, 2026Updated 2 months ago
- React wrapper for ngl☆23Mar 6, 2023Updated 3 years ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- AiiDA plugin that makes running shell commands easy.☆17Jan 14, 2026Updated 2 months ago
- An AiiDA plugin for dynamically defining workflows using Python functions☆18Jun 10, 2022Updated 3 years ago
- Implementation of Koopmans-compliant functionals in Quantum ESPRESSO☆17Mar 5, 2026Updated last month
- Manage conda environments and packages with Ansible☆15Nov 19, 2021Updated 4 years ago
- A widget to visualize and edit atomic structures in Jupyter Notebook☆47Feb 20, 2026Updated last month
- A repository for the implementation of common workflow interfaces across materials-science codes and plugins☆56Jan 9, 2026Updated 3 months ago
- Illustrating how to publish battery data☆13May 27, 2025Updated 10 months ago
- A general parser for VASP☆15Updated this week
- A universal file format for gas adsorption experiments☆22Mar 30, 2026Updated last week
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting with the flexibility to host WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Cloudways by DigitalOcean.
- Coarse-graining Hybrid and Inorganic Crystals (CHIC) is a Python package for automating the cleaning-up and coarse-graining of crystals a…☆14Nov 18, 2024Updated last year
- Typed schema for writing reactive scientific documents.☆18Aug 3, 2022Updated 3 years ago
- IUPAC Project 2019-031-1-024 FAIR Spectroscopy Data Specification☆12Mar 2, 2026Updated last month
- A python-based crystal viewer built upon the fresnel and pymatgen libraries.☆16May 20, 2024Updated last year
- AiiDA plugin of the high-performance density functional theory code JuKKR (www.judft.de) for high-throughput electronic structure calcula…☆16Sep 1, 2025Updated 7 months ago
- CRIPT Python SDK☆11Apr 13, 2023Updated 2 years ago
- Toolkit using the Atomistic Simulation Environment (ASE)☆20May 7, 2020Updated 5 years ago
- Python binding for Citrine's GEMD data model☆13Mar 25, 2026Updated 2 weeks ago
- A Working Group on connecting and advancing interoperability of efforts on automated extraction of metadata from materials and chemical f…☆14Nov 19, 2025Updated 4 months ago
- Virtual machines for every use case on DigitalOcean • AdGet dependable uptime with 99.99% SLA, simple security tools, and predictable monthly pricing with DigitalOcean's virtual machines, called Droplets.
- This repository contains organizational notes and details for the CECAM MADICES workshop, 7th-9th February 2022.☆13Feb 22, 2022Updated 4 years ago
- Implements core functions for AiiDAlab.☆16Apr 1, 2026Updated last week
- A graph database tool for experimental data in materials science and chemistry.☆19Jan 7, 2025Updated last year
- Tools for implementing and consuming OPTIMADE APIs in Python☆89Mar 30, 2026Updated last week
- ☆25Jan 22, 2025Updated last year
- ☆18Feb 1, 2023Updated 3 years ago
- The official AiiDA plugin for Quantum ESPRESSO☆77Apr 1, 2026Updated last week
- A version of sphinx-apidoc with support for templating☆32May 10, 2021Updated 4 years ago
- A code to estimate transport coefficients from the cepstral analysis of a (multi)variate current stationary time series -- [FKA "thermoce…☆45Sep 4, 2025Updated 7 months ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click and start building anything your business needs.
- The official AiiDA plugin for Phonopy☆21Mar 23, 2026Updated 2 weeks ago
- A Python package for adding uncertainties to neural network models of chemical systems.☆27Jul 5, 2022Updated 3 years ago
- A demonstration with examples of setting up an input device with custom key mappings or functions using udev☆10Aug 22, 2018Updated 7 years ago
- Python wrappers for the FirecREST API☆12Mar 16, 2026Updated 3 weeks ago
- A sphinx extension to create figures with multiple images☆13Mar 16, 2026Updated 3 weeks ago
- LAMMPS extension to capture electron-ion interaction. This is a mirror of https://gitlab.com/artuuuro/USER-EPH.☆18Mar 31, 2025Updated last year
- Graph neural network for predicting energy of known and hypothetical crystal structures☆10Jan 26, 2022Updated 4 years ago