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[WIP] Improvement of documentation #270

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celinehalkali Nov 26, 2024
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Added to contributors.
celinehalkali Nov 26, 2024
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celinehalkali Nov 26, 2024
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celinehalkali Nov 26, 2024
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5 changes: 5 additions & 0 deletions docs/about/contributors.md
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Expand Up @@ -58,6 +58,11 @@ University of Oxford
[MorrowChem]: https://github.com/morrowchem
[0000-0002-3441-8646]: https://orcid.org/0000-0002-3441-8646

**Celine Halkali** [![gh]][celinehalkali] (Documentation)\
Montanuniversität Leoben

[celinehalkali]: https://github.com/celinehalkali
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@QuantumChemist QuantumChemist Nov 26, 2024

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@JaGeo thank you for the reminder!
@celinehalkali 🥳



We welcome contributions from other researchers! If you would like to contribute, please see the `How to contribute` guidelines.

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2 changes: 1 addition & 1 deletion docs/user/installation/installation.md
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Expand Up @@ -17,7 +17,7 @@ This involves the following software packages:
We are also referring the user to the [installation guide of atomate2](https://materialsproject.github.io/atomate2/user/install.html) in order to setup the mandatory prerequisites to
be able to use `autoplex`.

After setting up `atomate2`, make sure to add `VASP_INCAR_UPDATES: {"NPAR": number}` in your ~/atomate2/config/atomate2.yaml file.
After setting up `atomate2`, make sure to add `VASP_INCAR_UPDATES: {"NPAR": number}` in your ~/atomate2/config/atomate2.yaml file.
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@QuantumChemist QuantumChemist Nov 26, 2024

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test comment

Set a number that is a divisor of the number of tasks you use for the VASP calculations.


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