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	An electron momentum spectroscopy investigation on the 1a' inner valence orbital of cyclopentene
	Su, GL ; Ren, XG ; Zhang, SF ; Ning, CG ; Zhou, H ; Li, B ; Huang, F ; Li, GQ ; Deng, JK
	2010-05-06 ; 2010-05-06
关键词	cyclopentene inner valence orbital ionization energy electron momentum profiles electron correlation effects E,2E SPECTROSCOPY MOLECULES DIACETYL Physics, Multidisciplinary
中文摘要	The ionization energy spectrum and the spherically averaged momentum distribution of 1a' inner valance orbital for cyclopentene have been investigated by using a high resolution ( Delta E = 1.15 eV, Delta p approximate to 0.1 a.u.) electron momentum spectrometer. The impact energy was 1200eV plus binding energy ( i.e. 1202-1234eV) and a symmetric non-coplanar kinematics was employed. The experimental momentum profile of the 1a' inner valence orbital is obtained and compared with the theoretical momentum distributions calculated by using Hartree-Fock and density functional theory methods with the basis sets STO-3G, 6-31G, 6-311 + + G* * and aug-cc-pVTZ. The pole strength of the 1a' inner valence orbital is estimated and the electron correlation effects are discussed.
语种	中文 ; 中文
出版者	CHINESE PHYSICAL SOC ; BEIJING ; P O BOX 603, BEIJING 100080, PEOPLES R CHINA
内容类型	期刊论文
源URL	[http://hdl.handle.net/123456789/14451]
专题	清华大学
推荐引用方式 GB/T 7714	Su, GL,Ren, XG,Zhang, SF,et al. An electron momentum spectroscopy investigation on the 1a' inner valence orbital of cyclopentene[J],2010, 2010.
APA	Su, GL.,Ren, XG.,Zhang, SF.,Ning, CG.,Zhou, H.,...&Deng, JK.(2010).An electron momentum spectroscopy investigation on the 1a' inner valence orbital of cyclopentene..
MLA	Su, GL,et al."An electron momentum spectroscopy investigation on the 1a' inner valence orbital of cyclopentene".(2010).

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