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Research article

First published 2004-8

PLS prediction of hyperpolarizabilities for donor-bridge-acceptor organic systems

A.E. de A. Machado, B. de Barros Neto, A.A. de S. da Gama

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 2002-8

Ab Initio Study of the Dipole Hyperpolarizabilities of Uracil

Humberto Soscún, Elba Manrique, Javier Hernández

Journal of Computational Methods in Sciences and Engineering

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Research article

First published 2017-2

Physisorption of amino acids on TiO 2 : Changes in the nonlinear optical properties

Emildo Marcano, José Gregorio Cisneros, Johana Alayón [...]

Journal of Computational Methods in Sciences and Engineering

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Research article

First published 2012-7

Ab initio and DFT study of the dipole (hyper) polarizabilities of p-nitrophenylphosphine molecule

Johan Urdaneta, Yaneth Bermúdez, Ricardo Bracho [...]

Journal of Computational Methods in Sciences and Engineering

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Research article

First published 2010-5

Ab initio and DFT study of the static dipole (hyper)polarizabilities of benzaldehyde and thio-benzaldehyde molecules in gas phase

Humberto Soscún

Journal of Computational Methods in Sciences and Engineering

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Research article

First published 2004-11

A mean-field approach for the determination of the polarizabilities for the water molecule in liquid state

A.V. Gubskaya, P.G. Kusalik

Journal of Computational Methods in Sciences and Engineering

Open access

Research article

First published 2026

Optical limiting properties of free base porphyrins and their Sn(IV) complexes on the nanosecond timescale

Gambolo Kabeya, Godfred Sebiawu, Nande Mgedle [...]

Main Group Chemistry

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Research article

First published 2008-7

Vibrational versus electronic isotropic polarizability and first hyperpolarizability of a series of cis – Ru (II) – bipyridine complexes: A non-empirical investigation

Maammar Rekhis, Amar Saal, Carlo Adamo [...]

Journal of Computational Methods in Sciences and Engineering

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