AiiDA tutorial at ISSP of Univ. Tokyo

A two days AiiDA tutorial will be held at ISSP of the university Tokyo on 19, 20th of December 2019.

Plan

This is a training session to feel AiiDA (http://www.aiida.net/). People who want to join will get together by themselves. No financial support will be provided from this tutorial organizers. At this time, the number of participants will have to be kept minimum because we don’t have enough people to support participants. In the future in Japan, we hope we will have a larger AiiDA tutorial with more supporters.

In the hands-on tutorial, we will basically follow the previous AiiDA tutorial material (we will modify this material a little). Participants are requested to bring their own laptop computers with virtualbox installed and to setup Quantum Mobile. Then they will run their hands-on tutorials on their own computers.

Date & Location

On 19, 20th of December 2019 at Kashiwanoha campus station satelite of the university of Tokyo.

https://www.fc.u-tokyo.ac.jp/en/accessmap/

Schedule

19th 9:00 - 18:00

  • 9:00 - 9:30: Introduction to AiiDA

  • 9:30 - 12:00: Getting started

  • 12:00 - 13:00: Lunch

  • Afternoon: Verdi command line, Verdi shell and AiiDA objects, Submit, monitor and debug calculations

20th 9:00 - 17:00

  • 9:00 - 9:30: Presentation “Running phonon calculation with an iterative algorithm by AiiDA, AiiDA-VASP, and AiiDA-phonopy”

  • 9:30 - 12:00: Queries in AiiDA and Workflows

  • 12:00 - 13:00: Lunch

  • Afternoon: Queries in AiiDA and Workflows, and maybe more (e.g., setup AiiDA on one’s computer, AiiDA-VASP)

Organizers

  • Atsushi Togo (ESISM, Kyoto University)

  • Ikutaro Hamada (Osaka University)

  • Tetsuya Fukushima (ISSP, University of Tokyo)

Contact

Atsushi Togo (atz.togo@gmail.com)

Acknowledgement

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