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High-Throughput Computational Screening of Metal-Organic Frameworks for CH
4
/H
2
Separation by Synergizing Machine Learning and Molecular Simulation
Shihui Wang, Xiaoyu Xue, Min Cheng, Shaochen Chen, Chong Liu, Li Zhou, Kexin Bi, Xu Ji
Acta Chimica Sinica . 2022, (
5
): 614 -624 . DOI: 10.6023/A22010031
