Nonlinear optical properties of novel thiophene derivatives: Experimental and ab initio time‐dependent coupled perturbed Hartree–Fock studies

The Journal of Chemical Physics ◽

10.1063/1.465398 ◽

1993 ◽

Vol 99 (12) ◽

pp. 9984-9993 ◽

Author(s):

Shashi P. Karna ◽

Yue Zhang ◽

Marek Samoc ◽

P. N. Prasad ◽

Bruce A. Reinhardt ◽

...

Keyword(s):

Optical Properties ◽

Ab Initio ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Time Dependent ◽

Hartree Fock ◽

Thiophene Derivatives

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ChemInform Abstract: Dispersion of Linear and Nonlinear Optical Properties of Benzene: An ab initio Time-Dependent Coupled-Perturbed Hartree-Fock Study.

10.1002/chin.199207032 ◽

2010 ◽

Vol 23 (7) ◽

pp. no-no

Author(s):

S. P. KARNA ◽

G. B. TALAPATRA ◽

P. N. PRASAD

Keyword(s):

Optical Properties ◽

Ab Initio ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Time Dependent ◽

Hartree Fock ◽

Linear And Nonlinear

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Nonlinear optical properties of p‐nitroaniline: An ab initio time‐dependent coupled perturbed Hartree–Fock study

The Journal of Chemical Physics ◽

10.1063/1.460024 ◽

1991 ◽

Vol 94 (2) ◽

pp. 1171-1181 ◽

Author(s):

Shashi P. Karna ◽

Paras N. Prasad ◽

Michel Dupuis

Keyword(s):

Optical Properties ◽

Ab Initio ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Time Dependent ◽

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ChemInform Abstract: Nonlinear Optical Properties of p-Nitroaniline: An ab initio Time- Dependent Coupled Perturbed Hartree-Fock Study.

10.1002/chin.199120040 ◽

2010 ◽

Vol 22 (20) ◽

pp. no-no

Author(s):

S. P. KARNA ◽

P. N. PRASAD ◽

M. DUPUIS

Keyword(s):

Optical Properties ◽

Ab Initio ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Time Dependent ◽

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Nonlinear Optical Properties of Threefold Coordinated Paramagnetic Si Centers: An ab Initio Time-Dependent Hartree−Fock Study on SiH3Radical†

The Journal of Physical Chemistry A ◽

10.1021/jp9941817 ◽

2000 ◽

Vol 104 (20) ◽

pp. 4735-4738 ◽

Author(s):

Shashi P. Karna

Keyword(s):

Optical Properties ◽

Ab Initio ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Time Dependent ◽

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Geometrical effect on the nonlinear optical properties of model rigid-rod polymers. Ab initio time-dependent coupled Hartree-Fock studies

Chemical Physics Letters ◽

10.1016/0009-2614(95)00070-k ◽

1995 ◽

Vol 234 (4-6) ◽

pp. 390-394 ◽

Author(s):

Shashi P. Karna ◽

Vijaya Keshari ◽

Paras N. Prasad

Keyword(s):

Optical Properties ◽

Ab Initio ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Time Dependent ◽

Hartree Fock ◽

Geometrical Effect ◽

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Dispersion of linear and nonlinear optical properties of benzene: An ab initio time‐dependent coupled‐perturbed Hartree–Fock study

The Journal of Chemical Physics ◽

10.1063/1.461608 ◽

1991 ◽

Vol 95 (8) ◽

pp. 5873-5881 ◽

Author(s):

Shashi P. Karna ◽

Gautam B. Talapatra ◽

Paras N. Prasad

Keyword(s):

Optical Properties ◽

Ab Initio ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Time Dependent ◽

Hartree Fock ◽

Linear And Nonlinear

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New algorithm for high-order time-dependent hartree-fock theory for nonlinear optical properties

International Journal of Quantum Chemistry ◽

10.1002/qua.560430111 ◽

1992 ◽

Vol 43 (1) ◽

pp. 119-134 ◽

Author(s):

Hideo Sekino ◽

Rodney J. Bartlett

Keyword(s):

Optical Properties ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Time Dependent ◽

Hartree Fock ◽

High Order Time

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Ab initio finite oligomer method for nonlinear optical properties of conjugated polymers. Hartree–Fock static longitudinal hyperpolarizability of polyacetylene

The Journal of Chemical Physics ◽

10.1063/1.469262 ◽

1995 ◽

Vol 102 (13) ◽

pp. 5350-5356 ◽

Author(s):

Bernard Kirtman ◽

Joseph L. Toto ◽

Kathleen A. Robins ◽

Muhammad Hasan

Keyword(s):

Optical Properties ◽

Conjugated Polymers ◽

Ab Initio ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

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Time-dependent Hartree-Fock calculations of the quadratic polarizability dispersion for molecules with pronounced nonlinear optical properties

Optics Communications ◽

10.1016/0030-4018(93)90056-b ◽

1993 ◽

Vol 95 (1-3) ◽

pp. 92-96 ◽

Author(s):

M.M. Mestechkin ◽

G.E. Whyman

Keyword(s):

Optical Properties ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Time Dependent ◽

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Ab initio Hartree-Fock calculations on linear and second-order nonlinear optical properties of new acridine-benzothiazolylamine chromophores

Journal of Molecular Modeling ◽

10.1007/s00894-007-0258-8 ◽

2008 ◽

Vol 14 (2) ◽

pp. 161-169 ◽

Author(s):

Davut Avcı ◽

Hüseyin Cömert ◽

Yusuf Atalay

Keyword(s):

Optical Properties ◽

Ab Initio ◽

Nonlinear Optical ◽

Second Order ◽

Nonlinear Optical Properties ◽

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