AiiDA: automated interactive infrastructure and database for computational science

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Title
AiiDA: automated interactive infrastructure and database for computational science
Authors
Keywords
High-throughput, Materials database, Scientific workflow, Directed acyclic graph, Provenance, Reproducibility
Journal
COMPUTATIONAL MATERIALS SCIENCE
Volume 111, Issue -, Pages 218-230
Publisher
Elsevier BV
Online
2015-10-02
DOI
10.1016/j.commatsci.2015.09.013

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