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README.html

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</script>
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_sources/index.rst

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If you use OSSCAR notebooks or technology, we would appreciate if you could cite the following paper:
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| D. Du, T. Baird, S. Bonella and G. Pizzi, OSSCAR, an open platform for collaborative development of computational tools for education in science,
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For the notebooks and the project
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----------------------------------
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| 1. D. Du, T. Baird, S. Bonella and G. Pizzi, OSSCAR, an open platform for collaborative development of computational tools for education in science,
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*Computer Physics Communications*, **282**, 108546 (2023).
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| `https://doi.org/10.1016/j.cpc.2022.108546 <https://doi.org/10.1016/j.cpc.2022.108546>`_
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For the widgets and extensions
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----------------------------------
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| 2. D. Du, T. J. Baird, K. Eimre, S. Bonella, G. Pizzi, Jupyter widgets and extensions for education and research in computational physics and chemistry, *Computer Physics Communications*, **305**, 109353 (2024).
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| `https://doi.org/10.1016/j.cpc.2024.109353 <https://doi.org/10.1016/j.cpc.2024.109353>`_
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.. image:: logos.png
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:width: 800
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:align: center

_static/scripts/pydata-sphinx-theme.js

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_static/styles/pydata-sphinx-theme.css

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_static/styles/pydata-sphinx-theme.css.map

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_static/webpack-macros.html

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-->
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{# Load FontAwesome icons #}
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{% macro head_pre_icons() %}
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about/index.html

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</script>
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about/roadmap.html

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<button class="btn btn-sm pst-navbar-icon search-button search-button__button" title="Search" aria-label="Search" data-bs-placement="bottom" data-bs-toggle="tooltip">
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