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Browse files
app.py
CHANGED
@@ -209,7 +209,7 @@ warning_message += " application."
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warning_message += "<br> Additionally, we have provided the 110 PBE correction method"
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warning_message += " from <a href='https://chemrxiv.org/engage/api-gateway/chemrxiv/assets/orp/resource/item/67252d617be152b1d0b2c1ef/original/a-simple-linear-relation-solves-unphysical-dft-energy-corrections.pdf' target='_blank'>Rohr et al (2024)</a>.<br>"
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message =
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warning_message
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)
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message += "<br>Built with <a href='https://pymatgen.org/' target='_blank'>Pymatgen</a> and <a href='https://docs.crystaltoolkit.org/' target='_blank'>Crystal Toolkit</a>.<br>"
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@@ -225,9 +225,10 @@ iface = gr.Interface(
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functional_dropdown,
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finite_temp_toggle,
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],
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outputs=gr.Plot(label="Phase Diagram"),
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title="LeMaterial - Phase Diagram Viewer",
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description=message,
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)
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# Launch the app
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warning_message += "<br> Additionally, we have provided the 110 PBE correction method"
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warning_message += " from <a href='https://chemrxiv.org/engage/api-gateway/chemrxiv/assets/orp/resource/item/67252d617be152b1d0b2c1ef/original/a-simple-linear-relation-solves-unphysical-dft-energy-corrections.pdf' target='_blank'>Rohr et al (2024)</a>.<br>"
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message = "{}. <br><br> Generate a phase diagram for a set of elements using LeMat-Bulk data.".format(
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warning_message
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)
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message += "<br>Built with <a href='https://pymatgen.org/' target='_blank'>Pymatgen</a> and <a href='https://docs.crystaltoolkit.org/' target='_blank'>Crystal Toolkit</a>.<br>"
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functional_dropdown,
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finite_temp_toggle,
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],
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+
outputs=gr.Plot(label="Phase Diagram", elem_classes="plot-out"),
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title="LeMaterial - Phase Diagram Viewer",
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description=message,
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css=".plot-out {background-color: #ffffff;}",
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)
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# Launch the app
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