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Official implementation of MatterGen -- a generative model for inorganic materials design across the periodic table that can be fine-tuned to steer the generation towards a wide range of property c…

Python 1,674 312 Updated Feb 27, 2026

Toolset for converting DAMASK 2 material and load configuration files to DAMASK 3, generating necessary simulation templates, and integrating data from Dream3D, ensuring compatibility and streamlin…

Jupyter Notebook 4 Updated Sep 18, 2023

Python functions to create N-dimensional mechanical linkages consisting of struts and joints similar to the Strandbeest by Theo Jansen. The scripts allow one to treat the mechanical network of link…

Python 6 Updated Mar 16, 2023

A Python library and command line interface for automated free energy calculations

Python 89 29 Updated Mar 30, 2026

Curated list of Industry 4.0 research, popular events, open-source software projects and learning resources that are worth looking into!

145 22 Updated May 29, 2021
Jupyter Notebook 3 Updated Nov 22, 2021

Curated list of known efforts in materials informatics, i.e. in modern materials science

501 106 Updated Mar 24, 2026