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Journal ArticleDOI

A new model of the third-order nonlinear optical systems which utilizes both through-bond and through-space charge-transfer effects: Polymeric systems with polar side chains

Masayoshi Nakano, +2 more
- 14 Jun 1991 - 
- Vol. 43, Iss: 3, pp 3755-3758
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TLDR
In this paper, the authors proposed the new polymeric systems with polar side chains which are expected to utilize both the through-bond and through-space interactions, and employed the coupled-Hartree-Fock (CHF) method to calculate the third-order hyperpolarizabilities for these systems.
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This article is published in Synthetic Metals.The article was published on 1991-06-14. It has received 5 citations till now. The article focuses on the topics: Space charge & Charge (physics).

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Journal ArticleDOI

Size-consistent approach and density analysis of hyperpolarizability: Second hyperpolarizabilities of polymeric systems with and without defects

TL;DR: In this paper, various size-consistent approaches to the calculation of molecular hyperpolarizabilities are analyzed based on the double perturbation theory and the coupled cluster theory.
Journal ArticleDOI

Relationship between spectral intensities and nonlinear optical properties

TL;DR: In this article, the relationship between hyperpolarizability (β) and spectral intensities has been investigated for polyene (or oligoene) systems with anharmonic terms included.
Journal ArticleDOI

Numerical Liouville approach: Formulation of third‐order nonlinear optical susceptibilities

TL;DR: In this article, the Fourier transformation of numerically exact solutions of the Liouville equation is used to provide both real and imaginary nonlinear optical spectra valid for arbitrary laser intensities, frequencies, and relaxation.
Journal ArticleDOI

Numerical Liouville approach: Three‐type analysis of virtual excitation processes of third‐order nonlinear optical spectra in third‐harmonic generation

TL;DR: In this paper, an analysis method based on virtual excitation processes is developed in numerical Liouville approach, which is a new nonperturbative method presented before, in which third-order nonlinear optical susceptibilities χ(3)g(ω) obtained by the NLA method can be divided into three types of virtual excitations.
Journal ArticleDOI

Theoretical Studies for Third-Order Hyperpolarizabilities of Alternant and Condensed-Ring Conjugated Systems I

TL;DR: In this article, the dependences of basis sets and electron correlation effects on the third-order hyperpolarizabilities of allyl systems were examined, and it was found that the extended basis set with diffuse p and d functions and Moller-Plesset second-order perturbation (MP2) method are necessary for reasonable descriptions of at least relative tendencies for these charged states of the allyl system.
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