49 citations · 49 across the 1 of their papers we have counts for
Showing 2021Show all
2 papers · 1 filter
cond-mat.mtrl-sci2021
Thermodynamics and dielectric response of by data-driven modeling
Lorenzo Gigli, Max Veit, Michele Kotiuga +3
Modeling ferroelectric materials from first principles is one of the successes of density-functional theory, and the driver of much development effort, requiring an accurate descri…
physics.chem-ph2021★ 49 cited
Efficient implementation of atom-density representations
Félix Musil, Max Veit, Alexander Goscinski +5
Physically-motivated and mathematically robust atom-centred representations of molecular structures are key to the success of modern atomistic machine learning (ML) methods. They l…