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aiida-dftk

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AiiDA plugin for DFTK

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Direct dependencies21From release 0.1.0

Last observed21 Oct, 10:57 UTC

README

Version 0.1.0 documentation

AiiDA-DFTK Plugin

Overview

This is an AiiDA plugin for DFTK, providing support from the AiiDA side to integrate DFTK seamlessly.

Note: For complete integration of DFTK with the AiiDA ecosystem, the AiidaDFTK plugin is also required for the Julia side. See the setup documentation.

Documentation

There are four documentation files available to guide you through the setup and usage of the AiiDA-DFTK plugin:

Set-up: Learn how to set up the AiiDA-DFTK plugin.
Calculations: Discover how to run DFTK calculations using AiiDA.
Common Workflow: Explore how to run a DFTK calculation using AiiDA's common workflow system.

Contact

AiiDA-DFTK is currently maintained by:

Bruno Ploumhans: bruno.ploumhans@epfl.ch

Former authors:

Yihan Wu: yihan.wu@epfl.ch
Austin Zadoks: austin.zadoks@epfl.ch

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Versions 1

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Version	Published	Direct dependencies	Open version
0.1.0	17 Dec 2025	21

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aiidaplugins/aiida-dftk

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package:1287f46d803d4bd9c6e9a6c4a0b874bbae015cd174a18057d010f44a3c2cabd9