中国科学院机构知识库网格系统: Magnetic-Bottle and Velocity-Map Imaging Photoelectron Spectroscopy of APS(-) (A=C14H10 or Anthracene): Electron Structure, Spin-Orbit Coupling of APS(center dot), and Dipole-Bound State of APS(-)

Magnetic-Bottle and Velocity-Map Imaging Photoelectron Spectroscopy of APS(-) (A=C14H10 or Anthracene): Electron Structure, Spin-Orbit Coupling of APS(center dot), and Dipole-Bound State of APS(-)

文献类型：期刊论文


作者	Cummins, Christopher C.4; Govind, Niranjan 5; Wang, Xue-Bin 2; Yuan, Qin-qin 1,2,3; Yang, Zheng 2; Li, Ren-zhong 2; Transue, Wesley J.4; Li, Zhi-peng 2; Jiang, Ling 1
刊名	CHINESE JOURNAL OF CHEMICAL PHYSICS
出版日期	2018-08-01
卷号	31 期号:4 页码:463-470
关键词	Dibenzo-7-phosphanorbornadiene P-sulfide Electronic structure Spin-orbit coupling Dipole-bound state VMI photoelectron spectroscopy
ISSN号	1674-0068
DOI	10.1063/1674-0068/31/cjcp1805114
通讯作者	Wang, Xue-Bin(xuebin.wang@pnnl.gov)
英文摘要	Gaseous dibenzo-7-phosphanorbornadiene P-sulfide anions APS(-) (A-C14H10 or anthracene) were generated via electrospray ionization, and characterized by magnetic-bottle photoelectron spectroscopy, velocity-map imaging (VMI) photoelectron spectroscopy, and quantum chemical calculations. The electron affinity (EA) and spin-orbit (SO) splitting of the APS(center dot) radical are determined from the photoelectron spectra and Franck-Condon factor simulations to be EA=(2.62 +/- 0.05) eV and SO splitting=(43 +/- 7) meV. VMI photoelectron images show strong and sharp peaks near the detachment threshold with an identical electron kinetic energy (eKE) of 17.9 meV at three different detachment wavelengths, which are therefore assigned to autodetachment from dipole-bound anion states. The B3LYP/6-31++G(d, p) calculations indicate APS(center dot) has a dipole moment of 3.31 Debye, large enough to support a dipole-bound electron.
WOS关键词	CORRELATED MOLECULAR CALCULATIONS ; PHOSPHORUS-CONTAINING ANALOG ; GAUSSIAN-BASIS SETS ; SODIUM PHOSPHAETHYNOLATE ; GROUND-STATE ; ANION ; CHEMISTRY ; ION ; HETEROCYCLES ; NA(OCP)
资助项目	U.S. Department of Energy (DOE), Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences and Biosciences ; DOE's Office of Biological and Environmental Research ; National Science Foundation[CHE-1664799]
WOS研究方向	Physics
语种	英语
WOS记录号	WOS:000445660500012
出版者	CHINESE PHYSICAL SOC
资助机构	U.S. Department of Energy (DOE), Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences and Biosciences ; U.S. Department of Energy (DOE), Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences and Biosciences ; DOE's Office of Biological and Environmental Research ; DOE's Office of Biological and Environmental Research ; National Science Foundation ; National Science Foundation ; U.S. Department of Energy (DOE), Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences and Biosciences ; U.S. Department of Energy (DOE), Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences and Biosciences ; DOE's Office of Biological and Environmental Research ; DOE's Office of Biological and Environmental Research ; National Science Foundation ; National Science Foundation ; U.S. Department of Energy (DOE), Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences and Biosciences ; U.S. Department of Energy (DOE), Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences and Biosciences ; DOE's Office of Biological and Environmental Research ; DOE's Office of Biological and Environmental Research ; National Science Foundation ; National Science Foundation ; U.S. Department of Energy (DOE), Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences and Biosciences ; U.S. Department of Energy (DOE), Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences and Biosciences ; DOE's Office of Biological and Environmental Research ; DOE's Office of Biological and Environmental Research ; National Science Foundation ; National Science Foundation
源URL	[http://cas-ir.dicp.ac.cn/handle/321008/166948]
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	Wang, Xue-Bin
作者单位	1.Chinese Acad Sci, Dalian Inst Chem Phys, State Key Lab Mol React Dynam, Dalian 116023, Peoples R China 2.Pacific Northwest Natl Lab, Phys Sci Div, 902 Battelle Blvd,Blvd,POB 999,MS K8-88, Richland, WA 99352 USA 3.Univ Chinese Acad Sci, Beijing 100049, Peoples R China 4.MIT, Dept Chem, Cambridge, MA 02139 USA 5.Pacific Northwest Natl Lab, Environm Mol Sci Lab, POB 999,MS K8-91, Richland, WA 99352 USA
推荐引用方式 GB/T 7714	Cummins, Christopher C.,Govind, Niranjan,Wang, Xue-Bin,et al. Magnetic-Bottle and Velocity-Map Imaging Photoelectron Spectroscopy of APS(-) (A=C14H10 or Anthracene): Electron Structure, Spin-Orbit Coupling of APS(center dot), and Dipole-Bound State of APS(-)[J]. CHINESE JOURNAL OF CHEMICAL PHYSICS,2018,31(4):463-470.
APA	Cummins, Christopher C..,Govind, Niranjan.,Wang, Xue-Bin.,Yuan, Qin-qin.,Yang, Zheng.,...&Jiang, Ling.(2018).Magnetic-Bottle and Velocity-Map Imaging Photoelectron Spectroscopy of APS(-) (A=C14H10 or Anthracene): Electron Structure, Spin-Orbit Coupling of APS(center dot), and Dipole-Bound State of APS(-).CHINESE JOURNAL OF CHEMICAL PHYSICS,31(4),463-470.
MLA	Cummins, Christopher C.,et al."Magnetic-Bottle and Velocity-Map Imaging Photoelectron Spectroscopy of APS(-) (A=C14H10 or Anthracene): Electron Structure, Spin-Orbit Coupling of APS(center dot), and Dipole-Bound State of APS(-)".CHINESE JOURNAL OF CHEMICAL PHYSICS 31.4(2018):463-470.

入库方式： OAI收割

来源：大连化学物理研究所

下载0

Magnetic-Bottle and Velocity-Map Imaging Photoelectron Spectroscopy of APS(-) (A=C14H10 or Anthracene): Electron Structure, Spin-Orbit Coupling of APS(center dot), and Dipole-Bound State of APS(-)

其他版本