Theoretical study of the vibronic structure of the 1 1A1→1 1B2 and 1 1A1→1 3B2 electronic transitions in cyclopentadiene

Marek Z. Zgierski; Francesco Zerbetto

doi:10.1063/1.466192

Theoretical study of the vibronic structure of the 1 1A1→1 1B2 and 1 1A1→1 3B2 electronic transitions in cyclopentadiene

The Journal of Chemical Physics ◽

10.1063/1.466192 ◽

1993 ◽

Vol 99 (5) ◽

pp. 3721-3729 ◽

Cited By ~ 30

Author(s):

Marek Z. Zgierski ◽

Francesco Zerbetto

Keyword(s):

Theoretical Study ◽

Electronic Transitions ◽

Vibronic Structure

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Vibronic structure in the optical absorption spectra of phenylene vinylene oligomers: a joint experimental and theoretical study

Chemical Physics Letters ◽

10.1016/s0009-2614(95)01224-9 ◽

1995 ◽

Vol 247 (4-6) ◽

pp. 425-432 ◽

Cited By ~ 97

Author(s):

J. Cornil ◽

D. Beljonne ◽

Z. Shuia ◽

T.W. Hagler ◽

I. Campbell ◽

...

Keyword(s):

Optical Absorption ◽

Absorption Spectra ◽

Theoretical Study ◽

Phenylene Vinylene ◽

Optical Absorption Spectra ◽

Vibronic Structure

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Theoretical study of the singlet and triplet vertical electronic transitions of styrene by the symmetry adapted cluster-configuration interaction method

Chemical Physics ◽

10.1016/j.chemphys.2004.03.028 ◽

2004 ◽

Vol 302 (1-3) ◽

pp. 125-134 ◽

Cited By ~ 8

Author(s):

Jian Wan ◽

Hiroshi Nakatsuji

Keyword(s):

Configuration Interaction ◽

Theoretical Study ◽

Electronic Transitions ◽

Interaction Method ◽

Configuration Interaction Method ◽

Cluster Configuration

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A theoretical study of the structures and optical spectra of helical copper–silver clusters

Physical Chemistry Chemical Physics ◽

10.1039/c3cp55507k ◽

2014 ◽

Vol 16 (39) ◽

pp. 21039-21048 ◽

Cited By ~ 11

Author(s):

Christopher J. Heard ◽

Roy L. Johnston

Keyword(s):

Significant Role ◽

Theoretical Study ◽

Response Spectra ◽

Optical Response ◽

Optical Spectra ◽

Electronic Transitions ◽

Silver Clusters ◽

Local Geometry ◽

Icosahedral Clusters

Optical response spectra of AgnCu13−n+ Bernal spiral clusters show subtle variations by dopant site and loading. Comparison to nanorod-like and icosahedral clusters shows local geometry plays a significant role in electronic transitions at the sub-nanoscale.

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On the geometric structure, puckering potential and electronic transitions of monosilacyclobutanes and disilacyclobutanes – A theoretical study

Journal of Molecular Spectroscopy ◽

10.1016/j.jms.2011.03.019 ◽

2011 ◽

Vol 267 (1-2) ◽

pp. 178-185 ◽

Cited By ~ 9

Author(s):

Z.J. Cai ◽

Y.J. Shi

Keyword(s):

Geometric Structure ◽

Theoretical Study ◽

Electronic Transitions

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Theoretical study of the lowest electronic transitions of sulfur-bearing mesoionic compounds in gas-phase and in dimethyl sulfoxide

Chemical Physics Letters ◽

10.1016/j.cplett.2008.04.041 ◽

2008 ◽

Vol 457 (1-3) ◽

pp. 119-123 ◽

Cited By ~ 15

Author(s):

T.L. Fonseca ◽

H.C.B. de Oliveira ◽

M.A. Castro

Keyword(s):

Dimethyl Sulfoxide ◽

Gas Phase ◽

Theoretical Study ◽

Electronic Transitions

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A theoretical study of desorption induced by electronic transitions in alkali halides

Surface Science Letters ◽

10.1016/0167-2584(89)90128-x ◽

1989 ◽

Vol 217 (3) ◽

pp. A375

Author(s):

Noriaki Itoh ◽

A.M. Stoneham ◽

A.H. Harker

Keyword(s):

Theoretical Study ◽

Alkali Halides ◽

Electronic Transitions

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Vibronic structure of the near-infrared and visible electronic transitions of 7,7,8,8-tetracyanoquinodimethane radical anion

The Journal of Physical Chemistry ◽

10.1021/j100242a018 ◽

1983 ◽

Vol 87 (19) ◽

pp. 3657-3664 ◽

Cited By ~ 34

Author(s):

Ines Zanon ◽

Cesare Pecile

Keyword(s):

Radical Anion ◽

Near Infrared ◽

Electronic Transitions ◽

Vibronic Structure

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Electronic transitions of racemic ethylene-bridged bis(indenyl)-type siloxy substituted zirconocene dichlorides. A combined UV/VIS spectroscopic and theoretical study

Journal of the Chemical Society Dalton Transactions ◽

10.1039/b004583g ◽

2001 ◽

pp. 91-96 ◽

Cited By ~ 15

Author(s):

Nora I. Mäkelä ◽

Hilkka R. Knuuttila ◽

Mikko Linnolahti ◽

Tapani A. Pakkanen

Keyword(s):

Theoretical Study ◽

Electronic Transitions

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Vibronic structure fingerprints in NEXAFS: a theoretical study of 2-mercaptobenzoxazole

Chemical Physics Letters ◽

10.1016/s0009-2614(00)00762-4 ◽

2000 ◽

Vol 327 (1-2) ◽

pp. 7-12 ◽

Cited By ~ 9

Author(s):

O. Plashkevych ◽

H. Ågren ◽

V. Carravetta ◽

G. Contini ◽

G. Polzonetti

Keyword(s):

Theoretical Study ◽

Vibronic Structure

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Theoretical analysis of vibronic structure in absorption and fluorescence spectra of polyatomic molecules beyond the Condon approximation: Application to 11Ag↔21Ag and 11Ag↔11Bu electronic transitions in all-trans-1,3,5,7-octatetraene

Journal of Molecular Spectroscopy ◽

10.1016/j.jms.2013.02.005 ◽

2013 ◽

Vol 286-287 ◽

pp. 30-45 ◽

Cited By ~ 2

Author(s):

Reza Islampour ◽

Azam Khavaninzadeh ◽

Mahsasadat Miralinaghi

Keyword(s):

Theoretical Analysis ◽

Fluorescence Spectra ◽

Polyatomic Molecules ◽

Electronic Transitions ◽

Absorption And Fluorescence Spectra ◽

Vibronic Structure ◽

Condon Approximation

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