Simulating Vibronic Spectra without Born–Oppenheimer Surfaces

The Journal of Physical Chemistry Letters ◽

10.1021/acs.jpclett.1c00073 ◽

2021 ◽

pp. 3074-3081

Author(s):

Kevin Lively ◽

Guillermo Albareda ◽

Shunsuke A. Sato ◽

Aaron Kelly ◽

Angel Rubio

Keyword(s):

Vibronic Spectra

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Purely Electronic Transition Frequency from Magnetically Induced Diffuse Vibronic Spectra

Journal of Applied Spectroscopy ◽

10.1007/s10812-021-01213-4 ◽

2021 ◽

Author(s):

V. A. Tolkachev

Keyword(s):

Electronic Transition ◽

Transition Frequency ◽

Vibronic Spectra

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Vibronic spectra of the lower excited singlet states of styrene: A Time Dependent Density Functional Theory study

Chemical Physics Letters ◽

10.1016/j.cplett.2006.12.103 ◽

2007 ◽

Vol 435 (4-6) ◽

pp. 224-229 ◽

Author(s):

Mattijs de Groot ◽

Wybren Jan Buma

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Time Dependent ◽

Density Functional Theory Study ◽

Excited Singlet ◽

Functional Theory ◽

Vibronic Spectra ◽

Singlet States ◽

Excited Singlet States ◽

Dependent Density

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Vibronic spectra of molecular crystals with participation of non-totally symmetrical vibrations

physica status solidi (b) ◽

10.1002/pssb.2220440232 ◽

1971 ◽

Vol 44 (2) ◽

pp. 733-746 ◽

Author(s):

A. A. Serikov

Keyword(s):

Molecular Crystals ◽

Vibronic Spectra

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Vibronic Spectra and the Shell Models

Physical Review ◽

10.1103/physrev.185.1163 ◽

1969 ◽

Vol 185 (3) ◽

pp. 1163-1167 ◽

Author(s):

W. E. Bron

Keyword(s):

Vibronic Spectra ◽

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Hydrogen bonding between solvation shells around gd3+ from cooperative vibronic spectra

Chemical Physics Letters ◽

10.1016/0009-2614(81)80087-5 ◽

1981 ◽

Vol 80 (1) ◽

pp. 192-194 ◽

Author(s):

Michael Stavola ◽

J.M. Friedman ◽

R.A. Stepnoski ◽

Mark G. Sceats

Keyword(s):

Hydrogen Bonding ◽

Vibronic Spectra

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Effect of nonadiabaticity on the vibronic spectra of molecules

Journal of Applied Spectroscopy ◽

10.1007/bf00665558 ◽

1987 ◽

Vol 46 (2) ◽

pp. 167-171

Author(s):

Yu. V. Nefedov ◽

V. I. Baranov ◽

L. A. Gribov

Keyword(s):

Vibronic Spectra

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Spectral moments of vibrationally excited components of continuous vibronic spectra

The Journal of Chemical Physics ◽

10.1063/1.445765 ◽

1983 ◽

Vol 79 (12) ◽

pp. 5780-5784 ◽

Author(s):

Jeffrey A. Joens ◽

Edward J. Bair

Keyword(s):

Spectral Moments ◽

Vibrationally Excited ◽

Vibronic Spectra

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Average Energies of Combining States and Purely Electronic Transition Frequencies in Vibronic Spectra

Journal of Applied Spectroscopy ◽

10.1007/s10812-018-0727-0 ◽

2018 ◽

Vol 85 (5) ◽

pp. 845-849

Author(s):

V. A. Tolkachev

Keyword(s):

Electronic Transition ◽

Vibronic Spectra ◽

Combining States

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Conformational effects on vibronic spectra and excited state dynamics of 3-fluorobenzoic acid dimer

The Journal of Chemical Physics ◽

10.1063/1.1778383 ◽

2004 ◽

Vol 121 (11) ◽

pp. 5261-5271 ◽

Author(s):

Chayan K. Nandi ◽

Montu K. Hazra ◽

Tapas Chakraborty

Keyword(s):

Excited State ◽

Excited State Dynamics ◽

Vibronic Spectra ◽

Conformational Effects

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Theory of Vibronic Spectra

Optical Properties of Ions in Solids ◽

10.1007/978-1-4684-2787-5_6 ◽

1975 ◽

pp. 187-226 ◽

Author(s):

William A. Wall

Keyword(s):

Vibronic Spectra

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