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Research article

First published 2004-8

Dipole polarizability and second hyperpolarizability of difluoroacetylene: Basis set dependence and electron correlation effects

Miroslav Medveď, Benoît Champagne, Jozef Noga [...]

Journal of Computational Methods in Sciences and Engineering

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Research article

First published 1999-2

Theoretical Study on Metalloporphyrins with Large Second-order Hyperpolarizabilities †

Yong Zhang, Xiao-Zeng You

Journal of Chemical Research

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Research article

First published 2004-11

Third-order nonlinear optical responses of molecules in the intermediate and strong correlation regime: Variation of second hyperpolarizability in the bond dissociation

Masayoshi Nakano, Satoru Yamada, Kizashi Yamaguchi

Journal of Computational Methods in Sciences and Engineering

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Research article

First published 1996-8

Substituent Effects on the Second Hyperpolarizability of Thioxanthen–9–one and Its Derivatives

Takushi Sugino, Hiroshi Hashimoto, Yasuaki Muguruma [...]

Main Group Chemistry

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Research article

First published 2006-1

Intermolecular interaction effects on second hyperpolarizabilities of clusters including charged species

Masayoshi Nakano, Ryohei Kishi, Nozomi Nakagawa [...]

Journal of Computational Methods in Sciences and Engineering

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Research article

First published 2006-9

Microscopic polarization in ropes and films of aligned carbon nanotubes

Lasse Jensen, Anders L. Esbensen, Per-Olof Åstrand [...]

Journal of Computational Methods in Sciences and Engineering

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Research article

First published 2010-5

Enhanced first hyperpolarizability of donor-acceptor diethynylsilane oligomers

R.A. Brennand, A.E. de A. Machado

Journal of Computational Methods in Sciences and Engineering

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Research article

First published 2004-8

Electric dipole polarizability and hyperpolarizability of NCCN,NCCP,and PCCP

Tadeusz Pluta, Piotr Zerzucha

Journal of Computational Methods in Sciences and Engineering

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Research article

First published 2006-1

Elongation method and supermolecule approach for the calculation of nonlinear susceptibilities. Application to the 3-Methyl-4-Nitropyridine 1-Oxide and 2-Methyl-4-Nitroaniline crystals

Feng Long Gu, Maxime Guillaume, Edith Botek [...]

Journal of Computational Methods in Sciences and Engineering

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Research article

First published 2007-5

Ab initio investigation on the nonlinear optical properties of silicon clusters Si n (n=3–8)

Benoît Champagne, Maxime Guillaume, Didier Bégué [...]

Journal of Computational Methods in Sciences and Engineering

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