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1. mdi-group/mace-field mdi-group/mace-field Public

   Forked from ACEsuit/mace

   MACE-Field - Fast and accurate machine learning interatomic potentials under an external electric field for predicting dielectric properties.

   Python 17 1

2. Frost-group/PolaronMobility.jl Frost-group/PolaronMobility.jl Public

   Feynman's variational path-integral model for the Fröhlich polaron. Calculates temperature dependent polaron mobilities, and other polaron observables.

   Jupyter Notebook 33 10

3. mdi-group/2025-04-mace-field mdi-group/2025-04-mace-field Public

   This repository contains the manuscript source, analysis scripts, figure exports, compact summaries, and lightweight reproducibility scaffolding for the paper "General learning of the electric resp…

   Jupyter Notebook 1

4. water-MACEField water-MACEField Public

   MACEField models and results for bulk water.

   Shell 2

5. Path-Integrals-For-Polarons-In-Materials Path-Integrals-For-Polarons-In-Materials Public

   PhD thesis on developing path integral methods for polarons in materials. Contains all the latex, data, plots and codes used to generate them all.

   TeX 1

6. Frost-group/PolaronQMC.jl Frost-group/PolaronQMC.jl Public

   Pigs might just fly.

   Julia 6