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PRACE-MaX Tutorial on high-throughput computatio ... (No replies)

szoup
7 years ago
szoup 7 years ago

We would like to remind you that the deadline of the following AiiDA tutorial is approaching! In the tutorial we will present how to use the AiiDA code (in combination with a number of quantum codes, including Quantum ESPRESSO) with particular focus also on the new features of the new AiiDA version.
Further information can be found at the tutorial's web-page: https://events.prace-ri.eu/event/709/overview

Description:
The PRACE-MaX tutorial is targeted at about 40 students, postdocs and researchers interested in applying high-throughput computations in their research, and in particular to those interested in learning how to use the AiiDA platform (a flexible and scalable informatics infrastructure to manage, preserve, and disseminate the simulations, data, and workflows of modern-day computational science).

The tutorial will be held by members of the AiiDA developers team (Sebastiaan Huber, Leonid Kahle, Giovanni Pizzi, Martin Uhrin and Spyros Zoupanos). Moreover, two scientific talks will be given by Giovanni Pizzi (Discovering two-dimensional materials from high-throughput computational exfoliation of experimentally known compounds) and Leonid Kahle (Fast screening of solid-state lithium-ion conductors) on their research using AiiDA and high-throughput.

The lunch for the three days as well as an evening buffet will be offered to all the participants by the tutorial sponsors. We will provide financial support to a limited number of accepted participants. More information can be found at the aforementioned tutorial webpage.

Important dates:
Start of registration: February, 3rd 2018
End of registration: April, 30th 2018
Contact of successful applicants: May, 7th 2018




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Ab initio (from electronic structure) calculation of complex processes in materials