ncfrey/litmatter

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Created about 3 years ago
Updated about 1 year ago

ncfrey/litmatter

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Rapid experimentation and scaling of deep learning models on molecular and crystal graphs.

resources

A Highly Opinionated List of Open Source Materials Informatics Resources

pumml

Positive and Unlabeled Materials Machine Learning (pumml) is a code that uses semi-supervised machine learning to classify materials from only positive and unlabeled examples.

pytopomat

Python Topological Materials (pytopomat) is a code for easy, high-throughput analysis of topological materials.

magnetic-topological-materials

Supplementary material for N. C. Frey, M. K. Horton, J. M. Munro, S. M. Griffin, K. A. Persson, and V. B. Shenoy, Science Advances 09 Dec 2020: Vol. 6, no. 50, eabd1076 DOI: 10.1126/sciadv.abd1076

Jupyter Notebook

rheed-viz

Database, dimensionality reduction, and visualization dashboard for RHEED data

Jupyter Notebook

slab-waveguide-eme

Eigenmode expansion solver of multilayer slab waveguide w/ single frequency incident light and dielectric perturbation.

defect-design

Supplementary material accompanying Frey, N. C.; Akinwande, D.; Jariwala, D.; Shenoy, V. B. Machine Learning-Enabled Design of Point Defects in 2D Materials for Quantum and Neuromorphic Information Processing, ACS Nano (2020).

Jupyter Notebook