Theoretical study of photoinduced electron transfer from tetramethylethylene to tetracyanoethylene

Hai Bo Yi; Xiao Hui Duan; Jin Yong Lee; Han Myoung Lee; Xiang Yuan Li; Kwang S. Kim

doi:10.1063/1.1613252

Theoretical study of photoinduced electron transfer from tetramethylethylene to tetracyanoethylene

Hai Bo Yi, Xiao Hui Duan, Jin Yong Lee, Han Myoung Lee, Xiang Yuan Li, Kwang S. Kim

Research output: Contribution to journal › Article › peer-review

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Abstract

The photoinduced electron transfer from tetramethylethylene to tetracyanoethylene was discussed. The photoexcitation of a charge-balanced electron donor-acceptor complex was studied using ab initio and density functional calculations. It was found that the transition energies in the polar solvent showed redshift relative to those in the gas phase.

Original language	English
Pages (from-to)	8854-8863
Number of pages	10
Journal	Journal of Chemical Physics
Volume	119
Issue number	17
DOIs	https://doi.org/10.1063/1.1613252
State	Published - 1 Nov 2003
Externally published	Yes

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title = "Theoretical study of photoinduced electron transfer from tetramethylethylene to tetracyanoethylene",

abstract = "The photoinduced electron transfer from tetramethylethylene to tetracyanoethylene was discussed. The photoexcitation of a charge-balanced electron donor-acceptor complex was studied using ab initio and density functional calculations. It was found that the transition energies in the polar solvent showed redshift relative to those in the gas phase.",

author = "Yi, \{Hai Bo\} and Duan, \{Xiao Hui\} and Lee, \{Jin Yong\} and Lee, \{Han Myoung\} and Li, \{Xiang Yuan\} and Kim, \{Kwang S.\}",

year = "2003",

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doi = "10.1063/1.1613252",

language = "English",

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TY - JOUR

T1 - Theoretical study of photoinduced electron transfer from tetramethylethylene to tetracyanoethylene

AU - Yi, Hai Bo

AU - Duan, Xiao Hui

AU - Lee, Jin Yong

AU - Lee, Han Myoung

AU - Li, Xiang Yuan

AU - Kim, Kwang S.

PY - 2003/11/1

Y1 - 2003/11/1

N2 - The photoinduced electron transfer from tetramethylethylene to tetracyanoethylene was discussed. The photoexcitation of a charge-balanced electron donor-acceptor complex was studied using ab initio and density functional calculations. It was found that the transition energies in the polar solvent showed redshift relative to those in the gas phase.

AB - The photoinduced electron transfer from tetramethylethylene to tetracyanoethylene was discussed. The photoexcitation of a charge-balanced electron donor-acceptor complex was studied using ab initio and density functional calculations. It was found that the transition energies in the polar solvent showed redshift relative to those in the gas phase.

UR - https://www.scopus.com/pages/publications/0344467243

U2 - 10.1063/1.1613252

DO - 10.1063/1.1613252

M3 - Article

AN - SCOPUS:0344467243

SN - 0021-9606

VL - 119

SP - 8854

EP - 8863

JO - Journal of Chemical Physics

JF - Journal of Chemical Physics

IS - 17

ER -

Theoretical study of photoinduced electron transfer from tetramethylethylene to tetracyanoethylene

Abstract

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