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AiiDA Tutorials
===============
+-----------------+-------------------------------------------------------------------+
| Related resources |
+=================+===================================================================+
| Virtual Machine | `Quantum Mobile 18.04.0-tutorial`_ (`installation instructions`_) |
+-----------------+-------------------------------------------------------------------+
| python packages | `aiida-core 1.0.0a1`_, `aiida-quantumespresso 3.0.0a1`_ |
+-----------------+-------------------------------------------------------------------+
| codes | `Quantum Espresso 6.2.1`_ |
+-----------------+-------------------------------------------------------------------+

The official home of AiiDA tutorial materials and videos.
.. _Quantum Mobile 18.04.0-tutorial: https://object.cscs.ch/v1/AUTH_b1d80408b3d340db9f03d373bbde5c1e/marvel-vms/quantum_mobile_aiida_tutorial_May_2018.ova
.. _installation instructions: https://object.cscs.ch/v1/AUTH_b1d80408b3d340db9f03d373bbde5c1e/marvel-vms/INSTALL_aiida_tutorial_May_2018.txt
.. _aiida-core 1.0.0a1: https://github.com/aiidateam/aiida_core/releases/tag/v1.0.0a1
.. _aiida-quantumespresso 3.0.0a1: https://github.com/aiidateam/aiida-quantumespresso/releases/tag/v3.0.0a1
.. _Quantum Espresso 6.2.1: https://github.com/QEF/q-e/releases/tag/qe-6.2.1

.. panels::
:body: bg-light text-center

------
:column: col-lg-12 pl-0 pr-0
PRACE-MaX tutorial on high-throughput computations
==================================================

.. link-button:: 2020_Intro_Week_Homepage
:type: ref
:text: In-Depth: 2020 Introductory Virtual tutorial
:classes: btn-link btn-block stretched-link
The `PRACE-MaX Tutorial on high-throughput computations: general methods
and applications using AiiDA <https://events.prace-ri.eu/event/709/>`__
was held from May 30th to June 1st, 2018 at the Cineca HPC facility in
Bologna, Italy.

-------
:column: col-lg-12 pl-0 pr-0
The instructions below have been converted from the `original LaTeX source
<https://github.com/aiidateam/aiida-tutorials-latex>`__.
See also the `original PDF <https://object.cscs.ch/v1/AUTH_b1d80408b3d340db9f03d373bbde5c1e/marvel-vms/aiida_tutorial_2018_05_text.pdf>`_.

:download:`AiiDA Cheat Sheet <cheatsheet/cheatsheet.pdf>`
.. seealso::

-------
:column: col-lg-12 pl-0 pr-0
:body: + font-weight-bold

Short Demonstrations

-------
:column: col-lg-6 col-xs-12 pl-0 pr-0

.. link-button:: Ljubljana 2019 Homepage
:type: ref
:text: Quantum ESPRESSO: Ljubljana 2019 tutorial
:classes: btn-link btn-block stretched-link

-------
:column: col-lg-6 col-xs-12 pl-0 pr-0

.. link-button:: Oxford 2020 Homepage
:type: ref
:text: Wannier90: "Virtual Edition" 2020 tutorial
:classes: btn-link btn-block stretched-link


Videos
------

For some events we have also recorded the lectures, that you can find here. You will also find the
links inside the respective sections.

.. Without this, the default list is indented more than the toctree list
.. rst-class:: toctree-l1

* `2019 tutorial lectures (aiida-core 1.0.0b3) <https://www.youtube.com/playlist?list=PL19kfLn4sO_-QtPaHAA8KByFluT2vvlG0>`_ (`mirror <https://www.bilibili.com/video/av64190843/>`_)
* `2019 plugin migration workshop lectures (aiida-core 1.0.0b2) <https://www.youtube.com/playlist?list=PL19kfLn4sO_9laPkLBdv935PquRxX8dCc>`_
* `2017 tutorial lectures (aiida-core 0.9.0) <https://www.youtube.com/playlist?list=PL19kfLn4sO_86ruxDP-sxbRXMuOr0VInR>`_
* `2017 short demo videos (aiida-core 0.8.0) <https://www.youtube.com/playlist?list=PL19kfLn4sO_-XDUeXu5jwUq9k7TId8mM0>`_
* `2016 tutorial lectures (aiida-core 0.6.0) <https://www.youtube.com/watch?v=qUNYEWClS2U&list=PL19kfLn4sO_86ruxDP-sxbRXMuOr0VInR&index=4>`_
:download:`The AiiDA Cheat Sheet <cheatsheet/cheatsheet.pdf>`

.. toctree::
:maxdepth: 1
:caption: Tutorial materials
:caption: Sections
:numbered:

2020, Introductory workshop Virtual Edition (aiida-core 1.3.0)<./pages/2020_Intro_Week/index>
2020, Wannier workshop Virtual Edition (aiida-core 1.1.1)<./pages/2020_Oxford/index>
2019, ISSP University of Tokyo, Chiba, Japan (aiida-core 1.0.1)<./pages/2019_ISSP_Chiba_Japan/index>
2019, IIT Mandi, Mandi, India (aiida-core 1.0.0b6)<./pages/2019_IIT_Mandi_India/index>
2019, SINTEF, Oslo, Norway (aiida-core 1.0.0b6)<./pages/2019_SINTEF/index>
2019, Jožef Stefan Institute, Ljubljana, Slovenia (aiida-core 1.0.0b6)<./pages/2019_Ljubljana/index>
2019, Xiamen University, Xiamen, China (aiida-core 1.0.0b6)<./pages/2019_Xiamen/index>
2019, EPFL, Lausanne, Switzerland (aiida-core 1.0.0b3)<./pages/2019_MARVEL_Psik_MaX/index>
2019, University of Amsterdam, Amsterdam, Netherlands (aiida-core 0.12.2)<./pages/2019_molsim_school_Amsterdam/index>
2018, Cineca, Bologna, Italy (aiida-core 1.0.0a1)<./pages/2018_PRACE_MaX/index>
2018, EPFL, Lausanne, Switzerland (aiida-core 0.11.4)<./pages/2018_EPFL_molsim/index>
2017, EPFL, Lausanne, Switzerland (aiida-core 0.9.0)<./pages/2017_MARVEL_Psik_MaX/index>
2017, ICTP, Trieste, Italy (aiida-core 0.7.1)<./pages/2017_ICTP/index>
2016, EPFL, Lausanne, Switzerland (aiida-core 0.6.0)<./pages/2016_MARVEL_Psik_MaX/index>
Preliminaries <./pages/2018_PRACE_MaX/sections/preliminaries>
./pages/2018_PRACE_MaX/sections/verdi_cmdline
./pages/2018_PRACE_MaX/sections/verdi_shell
./pages/2018_PRACE_MaX/sections/calculations
./pages/2018_PRACE_MaX/sections/querybuilder
./pages/2018_PRACE_MaX/sections/workflows
./pages/2018_PRACE_MaX/sections/bands

.. toctree::
:maxdepth: 1
:caption: Interactive demos
:caption: Appendices
:numbered:

interactive notebooks, binderized (aiida-core 0.12.3) <https://github.com/aiidateam/aiida_demos>
interactive notebooks (aiida-core 0.10.0) <https://github.com/aiidateam/aiida-max-examples>
./pages/2018_PRACE_MaX/sections/appendix_input_validation
./pages/2018_PRACE_MaX/sections/appendix_restarting_calculations
./pages/2018_PRACE_MaX/sections/appendix_queries
./pages/2018_PRACE_MaX/sections/appendix_workflow_logic
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