Density functional theory researches for atomic structure, properties prediction, and rational design of selective catalytic reduction catalysts: Current progresses and future perspectives by Bin Guan & Han Jiang & Yanfei Wei & Ziqian Liu & Xingze Wu & He Lin & Zhen Huang
Author:Bin Guan & Han Jiang & Yanfei Wei & Ziqian Liu & Xingze Wu & He Lin & Zhen Huang , Date: February 8, 2023
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Author:Bin Guan & Han Jiang & Yanfei Wei & Ziqian Liu & Xingze Wu & He Lin & Zhen Huang
Format: pdf
Tags: SCR, Quantum chemistry calculations, Density functional theory, Complicated reaction mechanism, Active sites, Modification and rationally designed
Publisher: Elsevier B.V.
Published: 2021-07-29T01:15:17+00:00
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