Third-Order Nonlinear Optical Behavior of 5,11,17,23-Tetracyano-25,26,27,28-Tetrahydroxycalix[4]arene: Ab-initio Quantum Mechanical Calculations

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Tarih

2011

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Yayıncı

IEEE

Erişim Hakkı

info:eu-repo/semantics/closedAccess

Özet

A potential nonlinear optical (NLO) compound has been designed. To provide an insight into the microscopic NLO properties of the title molecule, both dispersion-free (static) and also frequency-dependent (dynamic) linear polarizabilities (alpha) and third-order hyperpolarizabilities (gamma) at lambda = 825 - 1125 nm and 1050 - 1600 nm wavelength areas have been computed using time-dependent Hartree-Fock (TDHF) method. The ab-initio quantum mechanical results on (hyper)polarizabilities show that the examined compound might have microscopic third-order NLO phenomena with non-zero values.

Açıklama

13th International Conference on Transparent Optical Networks (ICTON) -- JUN 26-30, 2011 -- Stockholm, SWEDEN

Anahtar Kelimeler

nonlinear optic, time-dependent Hartree-Fock, linear polarizability, second hyperpolarizability

Kaynak

2011 13TH INTERNATIONAL CONFERENCE ON TRANSPARENT OPTICAL NETWORKS (ICTON)

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N/A

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