Molecular simulation combined with DFT calculation guided heteroatom-doped biochar rational design for highly selective and efficient CO2 capture

Hongxian Li, Minghui Tang*, Ling Wang, Qi Liu, Fan Yao, Zhiyuan Gong, Yunchao Li, Shengyong Lu, Jianhua Yan

*Corresponding author for this work

Research output: Contribution to journalArticlepeer-review

10 Citations (Scopus)

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Chemical Engineering