Active oversight and quality control in standard Bayesian optimization for autonomous experiments
Abstract The fusion of experimental automation and machine learning has catalyzed a new era in materials research, prominently featuring Gaussian Process (GP) Bayesian Optimization (BO) driven autonomous experiments. Here we introduce a Dual-GP approach that enhances traditional GPBO by adding a sec...
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Main Authors: | Sumner B. Harris, Rama Vasudevan, Yongtao Liu |
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Format: | Article |
Language: | English |
Published: |
Nature Portfolio
2025-01-01
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Series: | npj Computational Materials |
Online Access: | https://doi.org/10.1038/s41524-024-01485-2 |
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