(Q57771245)

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First hyperpolarizability of polymethineimine with long-range corrected functionals

article by Denis Jacquemin et al published 21 May 2007 in Journal of Chemical Physics

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First hyperpolarizability of polymethineimine with long-range corrected functionals (English)

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Rika Kobayashi

6

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Carlo Adamo

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Carlo Adamo

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7

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Denis Jacquemin

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Denis Jacquemin

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1

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Eric A. Perpète

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2

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Miroslav Medved’

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3

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Giovanni Scalmani

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4

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Michael J. Frisch

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5

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English

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21 May 2007

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Journal of Chemical Physics

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volume

126

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19

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191108

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Ab initio static polarizability and first hyperpolarizability of model polymethineimine chains. II. Effects of conformation and of substitution by donor/acceptor end groups

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21 January 2018

Møller–Plesset evaluation of the static first hyperpolarizability of polymethineimine

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21 January 2018

Geometry, dipole moment, polarizability and first hyperpolarizability of polymethineimine: An assessment of electron correlation contributions

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21 January 2018

Assessment of Conventional Density Functional Schemes for Computing the Dipole Moment and (Hyper)polarizabilities of Push−Pull π-Conjugated Systems†

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21 January 2018

Nonlinear optical property calculations by the long-range-corrected coupled-perturbed Kohn-Sham method.

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21 January 2018

Assessment of the efficiency of long-range corrected functionals for some properties of large compounds

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21 January 2018

Assessment of several hybrid DFT functionals for the evaluation of bond length alternation of increasingly long oligomers

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21 January 2018

Ab InitioCoupled Hartree−Fock Investigation of the Static First Hyperpolarizability of Modelall-trans-Polymethineimine Oligomers of Increasing Size

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21 January 2018

Electronic and vibrational first hyperpolarizabilities of polymethineimine oligomers

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21 January 2018

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10.1063/1.2741246

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PubMed publication ID

17523788

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(Q57771245)

First hyperpolarizability of polymethineimine with long-range corrected functionals

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