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aiidateam
AiiDA tutorials web site
@csadorf @unkcpz @superstar54 @chrisjsewell @mbercx
AiiDA v2.1 added a feature where inputs of process functions are automatically serialized (https://github.com/aiidateam/aiida-core/pull/5688). See the [docs](https://aiida.readthedocs.io/projects/aiida-core/en/latest/topics/calculations/concepts.html#calculation-functions). Essentially, what used to be written as: ```python from aiida.engine import calcfunction from...
Most bash cells look like this: ``` bash $ verdi daemon restart --reset ``` But the last one has the following extras (virtualenv, usr, computer, path): ``` bash (aiida) max@quantum-mobile:~/wf_basic$...
Probably this is more of an issue for the deployment, so feel free to move it. Tab completion does not work for me in the terminal. It starts working if...
The section on [dealing with errors](https://aiida-tutorials.readthedocs.io/en/tutorial-2022-intro/sections/writing_workflows/errors.html) reads a bit confusing to me. At least 2 things stand out: 1. The introduction already introduces a code box but without much context...
For example, if you go to [this](https://aiida-tutorials.readthedocs.io/en/tutorial-2022-intro/sections/writing_workflows/workchain.html#adding-the-steps-in-the-outline) snippet and use the copy function of the code box, you get the following: ``` python from aiida.orm import Int from aiida.engine import...
Hi Aiida experts. I am running the exerises in this page with `pseudo_family = load_group('PseudoDojo/0.4/PBE/SR/standard/upf')` But the process state keep as "Created".. I have tried `verdi daemon start` and `verdi...
