Photoelectron Velocity Map Imaging Spectroscopy of Heteronuclear Metal-Nickel Carbonyls MNi(CO)(n)(-) (M = Sc, Y; n=2-6)

doi:10.1007/s11244-017-0875-0

	Photoelectron Velocity Map Imaging Spectroscopy of Heteronuclear Metal-Nickel Carbonyls MNi(CO)(n)(-) (M = Sc, Y; n=2-6)
	Fan, Hongjun 1; Xie, Hua 1; Zou, Jinghan 1,2; Yuan, Qinqin 1,2; Zhang, Jumei 1,2; Jiang, Ling 1
刊名	TOPICS IN CATALYSIS
	2018-03-01
卷号	61 期号:1-2 页码:71-80
关键词	Photoelectron Spectroscopy Co Activation Heteronuclear Metal Carbonyl Quantum Chemical Calculation
ISSN号	1022-5528
DOI	10.1007/s11244-017-0875-0
文献子类	Article
英文摘要	The chemical bonding and electronic structure of heteronuclear metal-nickel carbonyls MNi(CO)(n)(-) (M = Sc, Y; n = 2-6) have been investigated by mass-selected photoelectron velocity map imaging spectroscopy and quantum chemical calculations. Two CO bonding modes (side-on-bonded and terminal carbonyls) are involved in the n = 2 cluster. The building block composed of three kinds of different CO modes (side-on-bonded, bridging, and terminal carbonyls) is favored at n = 3, the structure of which persists up to n = 6. The additional CO ligands are preferentially coordinated in the terminal mode to the Sc atom and then to the Ni atom in the larger clusters. The present findings would promote the understanding of CO molecule activation and chemisorbed CO molecules on metal surfaces.
WOS关键词	INFRARED PHOTODISSOCIATION SPECTROSCOPY ; DENSITY-FUNCTIONAL CALCULATIONS ; GAS-PHASE ; CLUSTER CATIONS ; COPPER CARBONYLS ; SOLID ARGON ; SPECTRA ; ATOMS ; MONOXIDE ; ANIONS
WOS研究方向	Chemistry
语种	英语
出版者	SPRINGER/PLENUM PUBLISHERS
WOS记录号	WOS:000428065700009
内容类型	期刊论文
源URL	[http://cas-ir.dicp.ac.cn/handle/321008/169068]
专题	大连化学物理研究所_中国科学院大连化学物理研究所
通讯作者	Jiang, Ling
作者单位	1.Chinese Acad Sci, Collaborat Innovat Ctr Chem Energy & Mat iChEM, Dalian Inst Chem Phys, State Key Lab Mol React Dynam, 457 Zhongshan Rd, Dalian 116023, Liaoning, Peoples R China 2.Univ Chinese Acad Sci, 19A Yuquan Rd, Beijing 100049, Peoples R China
推荐引用方式 GB/T 7714	Fan, Hongjun,Xie, Hua,Zou, Jinghan,et al. Photoelectron Velocity Map Imaging Spectroscopy of Heteronuclear Metal-Nickel Carbonyls MNi(CO)(n)(-) (M = Sc, Y; n=2-6)[J]. TOPICS IN CATALYSIS,2018,61(1-2):71-80.
APA	Fan, Hongjun,Xie, Hua,Zou, Jinghan,Yuan, Qinqin,Zhang, Jumei,&Jiang, Ling.(2018).Photoelectron Velocity Map Imaging Spectroscopy of Heteronuclear Metal-Nickel Carbonyls MNi(CO)(n)(-) (M = Sc, Y; n=2-6).TOPICS IN CATALYSIS,61(1-2),71-80.
MLA	Fan, Hongjun,et al."Photoelectron Velocity Map Imaging Spectroscopy of Heteronuclear Metal-Nickel Carbonyls MNi(CO)(n)(-) (M = Sc, Y; n=2-6)".TOPICS IN CATALYSIS 61.1-2(2018):71-80.