Radiative decay from doubly to singly excited states of He via generalization of Laguerre-type orbitals: A non-orthogonal formalism  

Radiative decay from doubly to singly excited states of He via generalization of Laguerre-type orbitals: A non-orthogonal formalism

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作  者:熊庄 Bacalis N C 

机构地区:[1]AMS Research Center, Southeast Uniwrsity, Nanjing 210096, China [2]Theoretical and Physical Chemistry Institute, National Hellenic Research Foundation, Vaslleos Constantinou 48, Athens 11635, Greece

出  处:《Chinese Physics B》2007年第2期374-381,共8页中国物理B(英文版)

基  金:Project supported by the National Natural Science Foundation of China (Grant No 10347126), National High Technology Development Program of China (Grant No 2004AA306H10) and the Program "Excellence in the Research Institutes Supervised by the General Secretariat for Research and Technology / Ministry of Development", Greece.Acknowledgments Xiong Zhuang would like to express his appreciation for the partial support from the Greek State Scholarship Foundation (I.K.Y.) and the National Hellenic Research Foundation Scholarship for this work.

摘  要:By taking full account of the non-orthogonality of the orbitals between the low-lying doubly excited states ^1po and the singly excited states ^1S^e and ^1D^e of He, the corresponding radiative decay rates have been investigated theoretically via analytic generalized Laguerre-type atomic orbitals at a nearly numerical multi-conflguration self-consistent field accuracy in a general non-orthogonal configuration interaction scheme. From these rates, we calculate the VUV photon emission and metastable atom spectra, and both are found to be in good qualitative agreement with recent excellent measurements. We obtain, successfully, the enhancement of the VUV photon spectrum, experimentally observed at the energy of (2s4p-4s2p)/(2p,3d) ^1po as compared with other nearby lying states. The mechanism proposed by Odling-Smee et al is verified, implying that taking appropriate account of the overlap existing between orbitals of the low-lying doubly excited and singly excited states (especially important for the compact orbitals) can reveal basic physical dominant mechanism and is crucial in understanding these spectra.By taking full account of the non-orthogonality of the orbitals between the low-lying doubly excited states ^1po and the singly excited states ^1S^e and ^1D^e of He, the corresponding radiative decay rates have been investigated theoretically via analytic generalized Laguerre-type atomic orbitals at a nearly numerical multi-conflguration self-consistent field accuracy in a general non-orthogonal configuration interaction scheme. From these rates, we calculate the VUV photon emission and metastable atom spectra, and both are found to be in good qualitative agreement with recent excellent measurements. We obtain, successfully, the enhancement of the VUV photon spectrum, experimentally observed at the energy of (2s4p-4s2p)/(2p,3d) ^1po as compared with other nearby lying states. The mechanism proposed by Odling-Smee et al is verified, implying that taking appropriate account of the overlap existing between orbitals of the low-lying doubly excited and singly excited states (especially important for the compact orbitals) can reveal basic physical dominant mechanism and is crucial in understanding these spectra.

关 键 词:doubly excited states  singly excited states analytic basis functions  non-orthogonality formalism 

分 类 号:O571.3[理学—粒子物理与原子核物理]

 

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