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Multiphoton absorption in expanded porphyrins
He Yuan-Hang2; Hui Ren-Jie2; YI Yuan-Ping1; Shuai Zhi-Gang1
2008-04-01
Source PublicationACTA PHYSICO-CHIMICA SINICA
ISSN1000-6818
Volume24Issue:4Pages:565-570
AbstractWe have calculated the multiphoton absorption cross-sections for three expanded porphyrin derivatives using the sum-over-states-involved tensor approach in combination with the strongly correlated multireference determinant single- and double-configuration interaction method. The calculated results showed that the two- and three-photon energies corresponding to the first peak of the multiphoton absorption spectra showed a decrease (red-shifted) with the number of inserted thiophene groups, whereas the cross sections showed a remarkable increase, particularly for three-photon absorption cross-section. However, the larger twist of the molecular plane for the expanded molecule resulted in an obvious drop in the increasing trend for three-photon absorption cross-section.
KeywordMultiphoton Absorption Sum-over-states-involved Tensor Approach Porphyrin Derivatives Multireference Determinant Configuration Interaction Method
Indexed BySCI
Language英语
WOS IDWOS:000255220500004
PublisherPEKING UNIV PRESS
Citation statistics
Cited Times:5[WOS]   [WOS Record]     [Related Records in WOS]
Document Type期刊论文
Identifierhttp://ir.iccas.ac.cn/handle/121111/65130
Collection中国科学院化学研究所
Corresponding AuthorShuai Zhi-Gang
Affiliation1.Chinese Acad Sci, Inst Chem, Beijing 100080, Peoples R China
2.Beijing Inst Technol, Sch Aerosp Sci & Engn, Beijing 100081, Peoples R China
Recommended Citation
GB/T 7714
He Yuan-Hang,Hui Ren-Jie,YI Yuan-Ping,et al. Multiphoton absorption in expanded porphyrins[J]. ACTA PHYSICO-CHIMICA SINICA,2008,24(4):565-570.
APA He Yuan-Hang,Hui Ren-Jie,YI Yuan-Ping,&Shuai Zhi-Gang.(2008).Multiphoton absorption in expanded porphyrins.ACTA PHYSICO-CHIMICA SINICA,24(4),565-570.
MLA He Yuan-Hang,et al."Multiphoton absorption in expanded porphyrins".ACTA PHYSICO-CHIMICA SINICA 24.4(2008):565-570.
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