Machine Learning Based Approaches to Accelerate Energy Materials

5 days ago - Peer review almost pushed Ulrich Pöschl to leave science. About 20 years ago, Pöschl, a chemist at the... SCIENCE CONCENTRATES ...
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http://pubs.acs.org/journal/aelccp

Machine Learning Based Approaches to Accelerate Energy Materials Discovery and Optimization ologies to materials use cases.4 For one of the benchmarked use cases, DFT-calculated band gap data was used to supplement an experimental band gap data set. The model that used transfer learning achieved the same performance with