Nonlinear optical properties of tetrahedral donor-acceptor octupolar molecules: Effective five-state model approach

Minhaeng Cho, Sun Young An, Hochan Lee, Isabelle Ledoux, Joseph Zyss

Research output: Contribution to journalArticle

45 Citations (Scopus)

Abstract

The molecular nonlinear optical properties of tetrahedral donor-acceptor molecules were theoretically descripted using a valence bond and four charge-transfer state model. Ab initio calculations of the first hyperpolarizabilities of three different series of tetrahedral molecules were carried out for the confirmation of the theoretical predictions. Octupolar molecule with tetrahedral symmetry was considered following a symmetry-based prescription.

Original languageEnglish
Pages (from-to)9165-9173
Number of pages9
JournalJournal of Chemical Physics
Volume116
Issue number21
DOIs
Publication statusPublished - 2002 Jun 1
Externally publishedYes

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Optical properties
optical properties
Molecules
molecules
symmetry
Charge transfer
charge transfer
valence
predictions

ASJC Scopus subject areas

  • Atomic and Molecular Physics, and Optics

Cite this

Nonlinear optical properties of tetrahedral donor-acceptor octupolar molecules : Effective five-state model approach. / Cho, Minhaeng; An, Sun Young; Lee, Hochan; Ledoux, Isabelle; Zyss, Joseph.

In: Journal of Chemical Physics, Vol. 116, No. 21, 01.06.2002, p. 9165-9173.

Research output: Contribution to journalArticle

Cho, Minhaeng ; An, Sun Young ; Lee, Hochan ; Ledoux, Isabelle ; Zyss, Joseph. / Nonlinear optical properties of tetrahedral donor-acceptor octupolar molecules : Effective five-state model approach. In: Journal of Chemical Physics. 2002 ; Vol. 116, No. 21. pp. 9165-9173.
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