Alternatives and similar repositories for aiidalab-docker-stack

Users that are interested in aiidalab-docker-stack are comparing it to the libraries listed below

• aiidalab / aiidalab-qe
  AiiDAlab App for Quantum ESPRESSO
  ☆17Updated 2 weeks ago
• microsoft / aiida-dynamic-workflows
  An AiiDA plugin for dynamically defining workflows using Python functions
  ☆17Updated 2 years ago
• aiidalab / aiidalab
  Implements core functions for AiiDAlab.
  ☆16Updated this week
• aiidateam / aiida-common-workflows
  A repository for the implementation of common workflow interfaces across materials-science codes and plugins
  ☆54Updated 6 months ago
• osscar-org / jupyterlab-mol-visualizer
  A JupyterLab launcher extension to view the molecular orbitals.
  ☆18Updated 8 months ago
• aiida-phonopy / aiida-phonopy
  Phonon for AiiDA
  ☆20Updated 2 months ago
• ashtonmv / pyrho
  A real-space DFT code
  ☆16Updated 4 years ago
• diffpy / diffpy.structure
  Crystal structure container and parsers for structure formats.
  ☆34Updated this week
• osscar-org / widget-bandsplot
  A Jupyter widget to plot bandstructure and density of states.
  ☆16Updated 8 months ago
• aiidateam / aiida-registry
  Find plugins for AiiDA
  ☆18Updated this week
• aiidateam / aiida-tutorials
  AiiDA tutorials web site
  ☆24Updated 8 months ago
• superstar54 / weas-widget
  A widget to visualize and edit atomic structures in Jupyter Notebook
  ☆33Updated 3 months ago
• aiidateam / aiida-submission-controller
  Some classes to help managing large number of submissions, while controlling the maximum number of submissions running at any given time
  ☆9Updated 4 months ago
• mpds-io / mpds-api
  Tutorials, notebooks, issue tracker, and website on the MPDS API: the data retrieval interface for the Materials Platform for Data Scienc…
  ☆27Updated last week
• aiidateam / aiida-quantumespresso
  The official AiiDA plugin for Quantum ESPRESSO
  ☆63Updated last month
• pyiron / executorlib
  Up-scale python functions for high performance computing (HPC)
  ☆32Updated this week
• Materials-Consortia / OPTIMADE
  Specification of a common REST API for access to materials databases
  ☆89Updated last month
• epfl-theos / koopmans
  Implementation of Koopmans-compliant functionals in Quantum ESPRESSO
  ☆16Updated 2 weeks ago
• Matgenix / turbomoleio
  Turbomoleio is a python package containing a set of tools for the generation of inputs and parsing of outputs for the TURBOMOLE quantum c…
  ☆20Updated 4 months ago
• JuDFTteam / aiida-fleur
  AiiDA plugin of the high-performance density functional theory code FLEUR (www.judft.de) for high-throughput electronic structure calcula…
  ☆14Updated this week
• JuDFTteam / aiida-kkr
  AiiDA plugin of the high-performance density functional theory code JuKKR (www.judft.de) for high-throughput electronic structure calcula…
  ☆14Updated last month
• chrisjsewell / ipymd
  Analysis of Molecular Dynamics output in the IPython Notebook
  ☆10Updated 8 years ago
• nomad-coe / electronic-parsers
  ☆20Updated 3 weeks ago
• jochym / qe-util
  Set of utilities for using Quantum-Espresso with ASE and ipython notebooks.
  ☆12Updated 7 years ago
• pyiron / pyiron_atomistics
  pyiron_atomistics - an integrated development environment (IDE) for atomistic simulation in computational materials science.
  ☆45Updated last week
• BIG-MAP / big-map-registry
  Registry for BIG-MAP apps and codes. Find the apps
  ☆10Updated this week
• sphuber / aiida-shell
  AiiDA plugin that makes running shell commands easy.
  ☆14Updated 3 weeks ago
• rsdefever / ele
  A lightweight package with the periodic table of the elements
  ☆12Updated 4 years ago
• aiidateam / aiida-cp2k
  The CP2K plugin for the AiiDA workflow and provenance engine.
  ☆24Updated last month
• mturiansky / abcv
  A python-based crystal viewer built upon the fresnel and pymatgen libraries.
  ☆16Updated last year