Designing mechanically tough graphene oxide materials using deep reinforcement learning
Abstract Graphene oxide (GO) is playing an increasing role in many technologies. However, it remains unanswered how to strategically distribute the functional groups to further enhance performance. We utilize deep reinforcement learning (RL) to design mechanically tough GOs. The design task is formu...
Main Authors: | Bowen Zheng, Zeyu Zheng, Grace X. Gu |
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Format: | Article |
Language: | English |
Published: |
Nature Portfolio
2022-11-01
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Series: | npj Computational Materials |
Online Access: | https://doi.org/10.1038/s41524-022-00919-z |
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