Electronic spectra of finite polyenes and polyacetylene obtained by electron and polarization propagator calculations

Christoph Liegener; Hans Ågren

doi:10.1007/BF01114106

Electronic spectra of finite polyenes and polyacetylene obtained by electron and polarization propagator calculations

Christoph Liegener^*
, Hans Ågren

^*Corresponding author for this work

Friedrich-Alexander University Erlangen-Nürnberg
Linköping University

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

2 Scopus citations

Abstract

Polyacetylene and the short polyenes are used as common test cases for demonstrating the capability of electron and polarization propagator theory to simulate various types of molecular electronic spectra.

Original language	English
Pages (from-to)	335-362
Number of pages	28
Journal	Theoretica Chimica Acta
Volume	89
Issue number	5-6
DOIs	https://doi.org/10.1007/BF01114106
State	Published - Dec 1994
Externally published	Yes

Keywords

Electron propagators, polarization propagators
Molecular electronic spectra
Polyacetylene
Polyenes
Propagator theory

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10.1007/BF01114106

Cite this

@article{e5b5fc908e0f4dc1a0081ec03dc7e3bd,

title = "Electronic spectra of finite polyenes and polyacetylene obtained by electron and polarization propagator calculations",

abstract = "Polyacetylene and the short polyenes are used as common test cases for demonstrating the capability of electron and polarization propagator theory to simulate various types of molecular electronic spectra.",

keywords = "Electron propagators, polarization propagators, Molecular electronic spectra, Polyacetylene, Polyenes, Propagator theory",

author = "Christoph Liegener and Hans {\AA}gren",

year = "1994",

month = dec,

doi = "10.1007/BF01114106",

language = "英语",

volume = "89",

pages = "335--362",

journal = "Theoretica Chimica Acta",

issn = "0040-5744",

publisher = "Springer Verlag",

number = "5-6",

}

TY - JOUR

T1 - Electronic spectra of finite polyenes and polyacetylene obtained by electron and polarization propagator calculations

AU - Liegener, Christoph

AU - Ågren, Hans

PY - 1994/12

Y1 - 1994/12

N2 - Polyacetylene and the short polyenes are used as common test cases for demonstrating the capability of electron and polarization propagator theory to simulate various types of molecular electronic spectra.

AB - Polyacetylene and the short polyenes are used as common test cases for demonstrating the capability of electron and polarization propagator theory to simulate various types of molecular electronic spectra.

KW - Electron propagators, polarization propagators

KW - Molecular electronic spectra

KW - Polyacetylene

KW - Polyenes

KW - Propagator theory

UR - https://www.scopus.com/pages/publications/34249773071

U2 - 10.1007/BF01114106

DO - 10.1007/BF01114106

M3 - 文章

AN - SCOPUS:34249773071

SN - 0040-5744

VL - 89

SP - 335

EP - 362

JO - Theoretica Chimica Acta

JF - Theoretica Chimica Acta

IS - 5-6

ER -

Electronic spectra of finite polyenes and polyacetylene obtained by electron and polarization propagator calculations

Abstract

Keywords

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