Kevin Ryczko

Deep learning and density-functional theory

Kevin Ryczko, David A. Strubbe, Isaac Tamblyn · Physical review. A/Physical review, A · 2019 · 125 citations · Full text

Natural Sciences, Chemistry, Physics +17

Extensive deep neural networks for transferring small scale learning to large scale systems

Kyle Mills, Kevin Ryczko, Iryna Luchak et al. · Chemical Science · 2019 · 60 citations · Full text

Natural Sciences, Materials Science, Physics +15

Convolutional neural networks for atomistic systems

Kevin Ryczko, Kyle Mills, Iryna Luchak et al. · Computational Materials Science · 2018 · 49 citations · Full text

Natural Sciences, Physics, Computational Chemistry +8

Toward Orbital-Free Density Functional Theory with Small Data Sets and Deep Learning

Kevin Ryczko, Sebastian J. Wetzel, Roger G. Melko et al. · Journal of Chemical Theory and Computation · 2022 · 47 citations · Full text

Natural Sciences, Chemistry, Physics +17

Crystal Site Feature Embedding Enables Exploration of Large Chemical Spaces

Hitarth Choubisa, Mikhail Askerka, Kevin Ryczko et al. · Matter · 2020 · 43 citations · Full text

Natural Sciences, Chemistry, Computational Chemistry +11