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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If you have done interesting work using #AiiDA or any of the other #MaX codes, this #MaX prize might be for you!… t.co/8IFETncYpn

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#AiiDA (and #MARVEL_NCCR and #MaX_CoE projects) presented today at the TERATEC 2017 index.html… t.co/XULISoQXeZ

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Report published for the last #MARVEL_NCCR/@max_center2/#PsiK high-throughput tutorial using #AiiDA: check it out! t.co/TytZnYdGzl

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1 month ago
MaX prize for flagship codes application – MaX Centre of Excellence

If you have done interesting work using #AiiDA or any of the other #MaX codes, this #MaX prize might be for you! #CoE #HPC http://www.max-centre.eu/2017/07/18/prize/

MaX – Materials at the Exascale aims at enabling advancements in materials research via high-performance and high-throughput computing towards the exascale. Its activities are largely centred on ... See more

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1 month ago
www.teratec.eu

AiiDA (and the #MARVEL_NCCR and #MaX_CoE projects) presented today at the TERATEC 2017 forum http://www.teratec.eu/gb/index.html http://www.teratec.eu/gb/forum/atelier_6.html

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1 month ago
Timeline Photos

Group photo from the workshop "Materials Genome Infrastructure and Materials Design” held in the Institute of Physics, Chinese Academy of Sciences, Beijing, China (Jun 12-13) where Sebastiaan P. ... See more

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