2 citations · 3 across the 4 of their papers we have counts for
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Parameter-Efficient Fine-Tuning of Machine-Learning Interatomic Potentials for Phonon and Thermal Properties
Jonas Grandel, Philipp Benner, Janine George
Machine-learning interatomic potentials are widely used as computationally efficient surrogates for density functional theory in atomistic simulations, enabling large-scale, long-t…
A critical assessment of bonding descriptors for predicting materials properties
Aakash Ashok Naik, Nidal Dhamrait, Katharina Ueltzen +4
Most machine learning models for materials science rely on descriptors based on materials compositions and structures, even though the chemical bond has been proven to be a valuabl…
Transport Novelty Distance: A Distributional Metric for Evaluating Material Generative Models
Paul Hagemann, Simon Müller, Janine George +1
Recent advances in generative machine learning have opened new possibilities for the discovery and design of novel materials. However, as these models become more sophisticated, th…