AiiDA
Automated Interactive Infrastructure and Database for Computational Science

AiiDA is a flexible and scalable informatics' infrastructure to manage, preserve, and disseminate the simulations, data, and workflows of modern-day computational science. Able to store the full provenance of each object, and based on a tailored database built for efficient data mining of heterogeneous results, AiiDA gives the user the ability to interact seamlessly with any number of remote HPC resources and codes, thanks to its flexible plugin interface and workflow engine for the automation of complex sequences of simulations.

Journal ref: G. Pizzi, A. Cepellotti, R. Sabatini, N. Marzari, and B. Kozinsky, AiiDA: automated interactive infrastructure and database for computational science, Comp. Mat. Sci. 111, 218-230 (2016)

Open access link: arXiv:1504.0116

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AiiDA Team
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Open position for a software engineer/web developer in the #MARVEL_NCCR t.co/uUoesUaMJq Full advert: t.co/4kTFnEDS20

AiiDA Team's Twitter avatar
AiiDA Team
@aiidateam

AiiDA demo playlist at t.co/70WBk74o2o! Get the notebooks at t.co/PI6plklJW0#MARVEL_NCCR @max_center2 @QuantumESPRESSO

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AiiDA Team
@aiidateam

Version 0.8.0 of #AiiDA is now out! Find it at t.co/FdyopoV2iD. #MARVEL #MaX @max_center2 @QuantumESPRESSO

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3 weeks ago
AiiDA short demos, April 2017 - YouTube

We have released a Youtube playlist collecting short demos of #AiiDA (2 to 5 minutes each, showing how to use Quantum ESPRESSO, #seekpath, the #SSSP pseudopotentials library, the #COD database, ...): ... See more

Series of short demonstrations of AiiDA features and capabilities. The notebooks used in the demo are publicly available at https://github.com/aiidateam/aiid...

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3 weeks ago
AiiDA – Download

Version 0.8.0 of #AiiDA is now out! Find it at http://aiida.net/download #MARVEL_NCCR #MaX_CoE Quantum ESPRESSO

AiiDA is a flexible and scalable informatics' infrastructure to manage, preserve, and disseminate the simulations, data, and workflows of modern-day computational science. Able to store the full ... See more

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2 months ago
AiiDA – Download

A new version of AiiDA (0.8.0rc2 - release candidate) is now available! You can find more information and download instructions at http://www.aiida.net/download/

AiiDA is a flexible and scalable informatics' infrastructure to manage, preserve, and disseminate the simulations, data, and workflows of modern-day computational science. Able to store the full ... See more

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