Accelerating the prediction of stable materials with machine learning

SD Griesemer, Y Xia, C Wolverton - Nature Computational Science, 2023 - nature.com
Despite the rise in computing power, the large space of possible combinations of elements
and crystal structure types makes large-scale high-throughput surveys of stable materials …

Phase stability through machine learning

R Arróyave - Journal of Phase Equilibria and Diffusion, 2022 - Springer
Understanding the phase stability of a chemical system constitutes the foundation of
materials science. Knowledge of the equilibrium state of a system under arbitrary …

Inverse design of metasurfaces with non-local interactions

H Cai, S Srinivasan, DA Czaplewski… - npj Computational …, 2020 - nature.com
Conventional metasurfaces have demonstrated efficient wavefront manipulation by using
thick and high-aspect-ratio nanostructures in order to eliminate interactions between …

Metastable materials discovery in the age of large-scale computation

F Therrien, EB Jones, V Stevanović - Applied Physics Reviews, 2021 - pubs.aip.org
Computational materials discovery has been successful in predicting novel, technologically
relevant materials. However, it has remained focused almost exclusively on finding ground …

Machine learning of phase transitions in nonlinear polariton lattices

D Zvyagintseva, H Sigurdsson, VK Kozin… - Communications …, 2022 - nature.com
Polaritonic lattices offer a unique testbed for studying nonlinear driven-dissipative physics.
They show qualitative changes of their steady state as a function of system parameters …