Machine learning-accelerated discovery and design of electrode materials and electrolytes for lithium ion batteries

The path towards sustainable energy

Steven Chu, Yi Cui, Nian Liu · Nature Materials · 2016 · 4.7K citations · Full text

Social Sciences, Environmental Engineering, Energy Policy +11

Graph Networks as a Universal Machine Learning Framework for Molecules and Crystals

Chi Chen, Weike Ye, Yunxing Zuo et al. · Chemistry of Materials · 2019 · 1.4K citations · Full text

Natural Sciences, Chemistry, Physics +17

Rational Molecular Design for Achieving Persistent and Efficient Pure Organic Room-Temperature Phosphorescence

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Natural Sciences, Chemistry, Physics +13

Machine learning assisted materials design and discovery for rechargeable batteries

Yue Liu, Biru Guo, Xinxin Zou et al. · Energy storage materials · 2020 · 446 citations

Natural Sciences, Materials Engineering, Materials Science +14

Holistic computational structure screening of more than 12 000 candidates for solid lithium-ion conductor materials

Austin D. Sendek, Qian Yang, Ekin D. Cubuk et al. · Energy & Environmental Science · 2016 · 432 citations

Natural Sciences, Chemistry, Materials Science +17