4 datasets found

<p>The development of machine-learning models for atomic-scale simulations has benefitted tremendously from the large databases of materials and molecular properties...

<p>Machine-learning interatomic potentials (MLIPs) have greatly extended the reach of atomic-scale simulations, offering the accuracy of first-principles calculations at a...

<p>Machine-learning interatomic potentials (MLIPs) have greatly extended the reach of atomic-scale simulations, offering the accuracy of first-principles calculations at a...

<p>The development of machine-learning models for atomic-scale simulations has benefitted tremendously from the large databases of materials and molecular properties...