Catalyst Design for Selective Hydrodeoxygenation of Glycerol to 1,3-Propanediol

doi:10.1021/acscatal.0c04167

	Catalyst Design for Selective Hydrodeoxygenation of Glycerol to 1,3-Propanediol
	Miao, Gai 1,2; Shi, Lei 1; Zhou, Zhimin 1,2; Zhu, Lijun 1,2; Zhang, Yanfei 1,2; Zhao, Xinpeng 1,2; Luo, Hu 1; Li, Shenggang1,2,3 ; Kong, Lingzhao 1,2; Sun, Yuhan1,2,3
	2020-12-18
发表期刊	ACS CATALYSIS (IF:11.3[JCR-2023],12.6[5-Year])
ISSN	2155-5435
卷号	10 期号:24 页码:15217-15226
DOI	10.1021/acscatal.0c04167
摘要	Biomass-derived glycerol is an ideal feedstock for replacing fossil resources in manufacturing propanediols (PDOs) via selective hydrodeoxygenation (HDO) because of the high atomic economy. However, it remains a great challenge to design a competitive HDO catalyst for selectively converting glycerol into 1,3-PDO owing to the higher thermodynamic stability of 1,2-PDO. In this work, theoretical analysis and first principles calculations were adopted for the design and development of an efficient HDO catalyst. The designed Pt/W/beta catalyst has low Pt and W loadings, and exhibits high performance in the HDO reaction with glycerol conversion (84.2%), 1,3-PDO selectivity (46.1%), and total C-3 alcohol selectivity (>90%) under mild reaction conditions. Furthermore, experimental structure-performance relationship of the HDO catalyst was found to be consistent with our first principles prediction, confirming the important role of the interfacial structure in the HDO reaction.
关键词	glycerol heterogeneous catalysis hydrodeoxygenation density functional theory calculations interfaces
收录类别	SCI ; SCIE ; EI
语种	英语
WOS研究方向	Chemistry
WOS类目	Chemistry, Physical
WOS记录号	WOS:000608850500076
出版者	AMER CHEMICAL SOC
WOS关键词	TUNGSTEN-OXIDE ; NOBLE-METALS ; HYDROGENOLYSIS ; CONVERSION ; WOX ; MORDENITE ; STABILITY ; CHEMICALS ; ZIRCONIA ; DEFECTS
原始文献类型	Article
引用统计	正在获取...
文献类型	期刊论文
条目标识符	https://kms.shanghaitech.edu.cn/handle/2MSLDSTB/125955
专题	物质科学与技术学院_特聘教授组_李圣刚组物质科学与技术学院_特聘教授组_孙予罕组
通讯作者	Li, Shenggang; Kong, Lingzhao; Sun, Yuhan
作者单位	1.Chinese Acad Sci, Shanghai Adv Res Inst, CAS Key Lab Low Carbon Convers Sci & Engn, Shanghai 201210, Peoples R China; 2.Univ Chinese Acad Sci, Beijing 100049, Peoples R China; 3.ShanghaiTech Univ, Sch Phys Sci & Technol, Shanghai 201210, Peoples R China
通讯作者单位	物质科学与技术学院
推荐引用方式 GB/T 7714	Miao, Gai,Shi, Lei,Zhou, Zhimin,et al. Catalyst Design for Selective Hydrodeoxygenation of Glycerol to 1,3-Propanediol[J]. ACS CATALYSIS,2020,10(24):15217-15226.
APA	Miao, Gai.,Shi, Lei.,Zhou, Zhimin.,Zhu, Lijun.,Zhang, Yanfei.,...&Sun, Yuhan.(2020).Catalyst Design for Selective Hydrodeoxygenation of Glycerol to 1,3-Propanediol.ACS CATALYSIS,10(24),15217-15226.
MLA	Miao, Gai,et al."Catalyst Design for Selective Hydrodeoxygenation of Glycerol to 1,3-Propanediol".ACS CATALYSIS 10.24(2020):15217-15226.