Speaker
Mani Lokamani
(HZDR)
Description
AiiDA is an open-source Python infrastructure for devising complex workflows associated with modern computational science and streamlining the four core pillars of the ADES model: Automation, Data, Environment, and Sharing. In this contribution, we showcase features of AiiDA like workflow-forging, high-throughput capability and data provenance as implemented in the AiiDA-FLEUR plugin. Finally, we address the possibility of managing AiiDA-projects through HELIPORT.
| Type | Talk |
|---|
Primary author
Mani Lokamani
(HZDR)
Co-authors
David Pape
(HZDR)
Guido Juckeland
(Helmholtz-Zentrum Dresden-Rossendorf)
Jeffrey Kelling
(HZDR)
Oliver Knodel
(Helmholtz-Zentrum Dresden-Rossendorf)
