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Targeted materials discovery using Bayesian algorithm execution

Published in arXiv (Cornell University) • Dec 26, 2023
NobleIDNI0P29W68R89S90
Authors:
Sathya R. Chitturi
,
Akash Ramdas
,
Yue Wu

Abstract

Rapid discovery and synthesis of new materials requires intelligent data acquisition strategies to navigate large design spaces. A popular strategy is Bayesian optimization, which aims to find candidates that maximize material properties; however, materials design often requires finding specific sub...

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