AiiDA registry of plugins

[View on GitHub/register your plugin]

Global summary of the AiiDA plugin registry

Total number of entries: 26

Calculations 56 plugins in 22 entries Parsers 50 plugins in 22 entries Data 22 plugins in 11 entries Workflows 40 plugins in 8 entries OtherCmdline data, Console scripts, TCOD plugins, Tests 39 plugins in 11 entries

Available plugins (alphabetically sorted)

ase: aiida-ase package

The official AiiDA plugin for ASE

Current state: stable

Plugin code homepage (hosted on github.com)

Documentation: Go to plugin documentation

Calculations 1 Parsers 1

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castep: aiida-castep package

AiiDA plugin for CASTEP

Current state: development

Plugin code homepage (hosted on gitlab.com)

Documentation: Go to plugin documentation

Calculations 5 Parsers 2 Data 2 Other (Tests, Cmdline data) 6

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codtools: aiida-codtools package

The official AiiDA plugin for COD tools

Current state: stable

Plugin code homepage (hosted on github.com)

Documentation: Go to plugin documentation

Calculations 6 Parsers 6

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cp2k: aiida-cp2k package

The CP2K plugin for the AiiDA workflow and provenance engine.

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Documentation not provided by the plugin author

Calculations 1 Parsers 1

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crystal17: aiida-crystal17 package

AiiDA plugin for running the CRYSTAL17 code

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Go to plugin documentation

Calculations 3 Parsers 1 Data 2 Workflows 1 Other (Cmdline data) 2

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ddec: aiida-ddec package

AiiDA plugin DDEC code

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Documentation not provided by the plugin author

Calculations 1 Parsers 1

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diff: aiida-diff package

AiiDA demo plugin that computes the difference between two files.

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Go to plugin documentation

Calculations 1 Parsers 1 Data 1 Other (Cmdline data) 1

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fleur: aiida-fleur package

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Go to plugin documentation

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gollum: aiida-gollum package

A plugin for Gollum functionality within AiiDA framework.

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Go to plugin documentation

Calculations 1 Parsers 1

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gudhi: aiida-gudhi package

AiiDA plugin for the [GUDHI](http://gudhi.gforge.inria.fr/) library for topological data analysis.

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Documentation not provided by the plugin author

Calculations 1 Parsers 1 Data 1

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kkr: aiida-kkr package

AiiDA plugin for the KKR code

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Go to plugin documentation

Calculations 4 Parsers 4 Data 1 Workflows 9 Other (Console scripts) 1

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lammps: aiida-lammps package

AiiDA plugin for LAMMPS

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Documentation not provided by the plugin author

Calculations 5 Parsers 4

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nwchem: aiida-nwchem package

The official AiiDA plugin for NWChem

Current state: stable

Plugin code homepage (hosted on github.com)

Documentation: Go to plugin documentation

Calculations 2 Parsers 3 Other (TCOD plugins, Tests) 2

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phonopy: aiida-phonopy package

AiiDA plugin for running phonon calculations using phonopy

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Go to plugin documentation

Calculations 2 Parsers 2 Data 5 Workflows 7

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phtools: aiida-phtools package

AiiDA plugin for persistence homology tools, used to analyze nanoporous materials.

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Documentation not provided by the plugin author

Calculations 2 Parsers 2 Data 1

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quantumespresso: aiida-quantumespresso package

The official AiiDA plugin for Quantum ESPRESSO

Current state: stable

Plugin code homepage (hosted on github.com)

Documentation: Go to plugin documentation

Calculations 12 Parsers 10 Data 1 Workflows 7 Other (Tests, Console scripts, TCOD plugins) 15

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quantumespresso-hp: aiida-quantumespresso-hp package

The AiiDA plugin for the Hubbard module of Quantum ESPRESSO

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Documentation not provided by the plugin author

Calculations 1 Parsers 1 Workflows 4 Other (Console scripts) 4

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raspa: aiida-raspa package

AiiDA plugin for RASPA code

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Documentation not provided by the plugin author

Calculations 1 Parsers 1 Workflows 1

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siesta: aiida-siesta package

A plugin for Siesta's basic functionality within AiiDA framework.

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Go to plugin documentation

Calculations 2 Parsers 2 Data 1 Other (Cmdline data) 1

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spex: aiida-spex package

Current state: registered

Plugin code homepage (hosted on github.com)

Documentation: Documentation not provided by the plugin author

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vasp: aiida-vasp package

AiiDA Plugin for running VASP calculations.

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Go to plugin documentation

Calculations 2 Parsers 3 Data 6 Workflows 10 Other (Console scripts, Cmdline data) 2

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wannier90: aiida-wannier90 package

AiiDA Plugin for Wannier90

Current state: stable

Plugin code homepage (hosted on github.com)

Documentation: Go to plugin documentation

Calculations 1 Parsers 1

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widgets: aiida-widgets package

AiiDA Lab widgets for the [AiiDA Lab](aiidalab.materialscloud.org).

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Documentation not provided by the plugin author

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yambo: yambo-aiida package

YAMBO code Plugin for AiiDA

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Documentation not provided by the plugin author

Calculations 1 Parsers 1 Other (Console scripts) 4

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z2pack: aiida-z2pack package

Current state: registered

Plugin code homepage (hosted on github.com)

Documentation: Documentation not provided by the plugin author

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zeopp: aiida-zeopp package

AiiDA plugin for zeo++

Current state: development

Plugin code homepage (hosted on github.com)

Documentation: Documentation not provided by the plugin author

Calculations 1 Parsers 1 Data 1 Workflows 1 Other (Console scripts) 1

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