Photoelectron Velocity Map Imaging Spectroscopy of Lead Tetracarbonyl-Iron Anion PbFe(CO)(4)(-)

doi:10.1021/acs.jpca.6b02786

	Photoelectron Velocity Map Imaging Spectroscopy of Lead Tetracarbonyl-Iron Anion PbFe(CO)(4)(-)
	Liu, Zhiling 2,3; Zou, Jinghan 2; Qin, Zhengbo 4; Xie, Hua 2; Fan, Hongjun 2; Tang, Zichao 1,2,5
刊名	JOURNAL OF PHYSICAL CHEMISTRY A
	2016-05-26
卷号	120 期号:20 页码:3533-3538
ISSN号	1089-5639
DOI	10.1021/acs.jpca.6b02786
文献子类	Article
英文摘要	Joint research of photoelectron velocity map imaging spectroscopy and density functional theory has been performed to probe the geometrical structures and electronic properties for heterodinuclear iron-lead carbonyl cluster PbFe(CO)(4)(-), which serves as a monomer of the metal-metal bonded oligomer. The photoelectron detachment of PbFe(CO)(4)(-) is recorded at two different photon energies with rich spectral features. The ground-state transition obtained at 532 nm reveals a broad vibrationally resolved spectral band, which corresponds to the lead iron stretching, while the 355 nm spectrum displays many more transitions on the higher-energy side, which correspond to the electronic excited states of PbFe(CO)(4). Theoretical calculations at the B3LYP level are performed to explore the ground states of both the anionic and neutral PbFe(CO)(4) and to support spectral identification of the fine resolved photoelectron spectra. Moreover, the unique chemical bonding between lead and iron in PbFe(CO)(4) is discussed with the aid of natural bond orbital analyses.
WOS关键词	STATE STRUCTURAL-CHARACTERIZATION ; COUPLED-CLUSTER ; CARBONYLS ; BONDS ; CRYSTALLIZATION ; SPECTROMETER ; GERMANIUM ; CRYSTAL ; DENSITY ; ANALOGS
WOS研究方向	Chemistry ; Physics
语种	英语
出版者	AMER CHEMICAL SOC
WOS记录号	WOS:000376841100017
内容类型	期刊论文
源URL	[http://cas-ir.dicp.ac.cn/handle/321008/170570]
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	Xie, Hua; Fan, Hongjun; Tang, Zichao
作者单位	1.Xiamen Univ, Coll Chem & Chem Engn, Collaborat Innovat Ctr Chem Energy Mat, State Key Lab Phys Chem Solid Surfaces, Xiamen 361005, Peoples R China 2.Chinese Acad Sci, Dalian Inst Chem Phys, State Key Lab Mol React Dynam, Dalian 116023, Peoples R China 3.Shanxi Normal Univ, Sch Chem & Mat Sci, Linfen 041004, Peoples R China 4.Anhui Normal Univ, Dept Phys, Wuhu 241000, Anhui, Peoples R China 5.Xiamen Univ, Coll Chem & Chem Engn, Dept Chem, Xiamen 361005, Peoples R China
推荐引用方式 GB/T 7714	Liu, Zhiling,Zou, Jinghan,Qin, Zhengbo,et al. Photoelectron Velocity Map Imaging Spectroscopy of Lead Tetracarbonyl-Iron Anion PbFe(CO)(4)(-)[J]. JOURNAL OF PHYSICAL CHEMISTRY A,2016,120(20):3533-3538.
APA	Liu, Zhiling,Zou, Jinghan,Qin, Zhengbo,Xie, Hua,Fan, Hongjun,&Tang, Zichao.(2016).Photoelectron Velocity Map Imaging Spectroscopy of Lead Tetracarbonyl-Iron Anion PbFe(CO)(4)(-).JOURNAL OF PHYSICAL CHEMISTRY A,120(20),3533-3538.
MLA	Liu, Zhiling,et al."Photoelectron Velocity Map Imaging Spectroscopy of Lead Tetracarbonyl-Iron Anion PbFe(CO)(4)(-)".JOURNAL OF PHYSICAL CHEMISTRY A 120.20(2016):3533-3538.