MPA₂

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1. k_SRME k_SRME Public

   Heat-conductivity benchmark test for foundational machine-learning potentials

   Python 31 5

2. autoWTE autoWTE Public

   Benchmarking foundation Machine Learning Potentials with Lattice Thermal Conductivity from Anharmonic Phonons

   Python 16 2

3. gamma_SRME gamma_SRME Public

   Benchmarking machine learning interatomic potentials with Grüneisen parameter.

   Python 5

4. Magnon Magnon Public

   Python 4

5. smooth-disorder smooth-disorder Public

   Smooth Disorder is a Python library that smoothly explains influence of structural disorder on the smoothness of vibrational density of states and interprets it in terms of disorder linewidth that …

   Jupyter Notebook