pyiron
Here are 52 public repositories matching this topic...
User developments to extend and modify core pyiron functionality
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May 13, 2024 - Python
build, analyse and visualise atomistic structures for materials science
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May 11, 2024 - Python
up-scale python functions for high performance computing
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May 7, 2024 - Python
pyiron_gpl - additional modules for the pyiron IDE licensed under GPLv3
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May 6, 2024 - Python
pyiron - an integrated development environment (IDE) for computational materials science.
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May 6, 2024 - Jupyter Notebook
OVITO Python file reader for the h5 data containers written by pyiron.
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Feb 27, 2024 - Python
Classical Spin Dynamics Simulation pyiron Workflow
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Mar 4, 2024 - Jupyter Notebook
pyiron job implementation for CINOLA wrapper
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Jan 22, 2024 - Python
A fully automated approach to determine the melting temperature of crystalline materials
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Jul 8, 2023 - Jupyter Notebook
Calculate elastic constants with LAMMPS and pyiron with no file system access
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Feb 19, 2023 - Jupyter Notebook
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