Austin M Mroz

Into the Unknown: How Computation Can Help Explore Uncharted Material Space

Victor Posligua, K. Jelfs, Andrew Tarzia, 2022, Journal of the American Chemical Society.

Computational workflow for steric assessment using the electric field-derived size

K. Jelfs, Lukas Turcani, Austin M Mroz, 2023, Electronic Structure.

Deep generative design of porous organic cages via a variational autoencoder

Kim E. Jelfs, Austin M Mroz, Jiajun Zhou, 2023, Digital discovery.