Frequency-dependent nonlinear optical properties with explicitly correlated coupled-cluster response theory using the CCSD(R12) model

The Journal of Chemical Physics ◽

10.1063/1.2716662 ◽

2007 ◽

Vol 126 (15) ◽

pp. 154101 ◽

Author(s):

Christian Neiss ◽

Christof Hättig

Keyword(s):

Optical Properties ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Coupled Cluster ◽

Response Theory ◽

Frequency Dependent ◽

Explicitly Correlated

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Simulating Third-Order Nonlinear Optical Properties Using Damped Cubic Response Theory within Time-Dependent Density Functional Theory

Journal of Chemical Theory and Computation ◽

10.1021/acs.jctc.5b01060 ◽

2016 ◽

Vol 12 (3) ◽

pp. 1294-1304 ◽

Author(s):

Zhongwei Hu ◽

Jochen Autschbach ◽

Lasse Jensen

Keyword(s):

Density Functional Theory ◽

Optical Properties ◽

Density Functional ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Time Dependent ◽

Response Theory ◽

Third Order ◽

Functional Theory ◽

Dependent Density

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Frequency dependent nonlinear optical properties of molecules: Formulation and implementation in the HONDO program

Journal of Computational Chemistry ◽

10.1002/jcc.540120409 ◽

1991 ◽

Vol 12 (4) ◽

pp. 487-504 ◽

Author(s):

S. P. Karna ◽

M. Dupuis

Keyword(s):

Optical Properties ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Frequency Dependent

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Frequency-dependent nonlinear optical properties of CdSe clusters

Physical Review B ◽

10.1103/physrevb.74.205435 ◽

2006 ◽

Vol 74 (20) ◽

Author(s):

Sabyasachi Sen ◽

Swapan Chakrabarti

Keyword(s):

Optical Properties ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Frequency Dependent

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Frequency dependent linear and nonlinear optical properties of compositionally tuned inorganic CsSnX (X = Br, I) composites

Journal of Alloys and Compounds ◽

10.1016/j.jallcom.2018.11.171 ◽

2019 ◽

Vol 779 ◽

pp. 497-504 ◽

Author(s):

Yee Hui Robin Chang ◽

Tiem Leong Yoon ◽

Thong Leng Lim ◽

Pin Wai Koh ◽

Moi Hua Tuh

Keyword(s):

Optical Properties ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Frequency Dependent ◽

Linear And Nonlinear

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Recent Advances in Explicitly Correlated Coupled-Cluster Response Theory for Excited States and Optical Properties

Progress in Physical Chemistry Volume 3 ◽

10.1524/9783486711639.93 ◽

2010 ◽

pp. 93-105

Author(s):

Jun Yang ◽

Christof Hättig

Keyword(s):

Optical Properties ◽

Excited States ◽

Coupled Cluster ◽

Response Theory ◽

Recent Advances ◽

Explicitly Correlated

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The Frequency Dependent Nonlinear Optical Properties of Thiophene-, Furan-, Pyrrole-Nitro Polyene Systems

Molecular Crystals and Liquid Crystals Science and Technology Section A Molecular Crystals and Liquid Crystals ◽

10.1080/10587259708032300 ◽

1997 ◽

Vol 294 (1) ◽

pp. 275-278

Author(s):

U-Sung Choi ◽

Choon-Bae Park ◽

Tae-Won Kim

Keyword(s):

Optical Properties ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Frequency Dependent

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Erratum: Spin‐unrestricted time‐dependent Hartree–Fock theory of frequency‐dependent linear and nonlinear optical properties [J. Chem. Phys. 104, 6590 (1996)]

The Journal of Chemical Physics ◽

10.1063/1.473019 ◽

1996 ◽

Vol 105 (14) ◽

pp. 6091-6091 ◽

Author(s):

Shashi P. Karna

Keyword(s):

Optical Properties ◽

Nonlinear Optical ◽

Chem Phys ◽

Nonlinear Optical Properties ◽

Time Dependent ◽

Frequency Dependent ◽

Hartree Fock ◽

Linear And Nonlinear

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Electronic structure and frequency-dependent third-order nonlinear optical properties of spin-12chain systemsA2CuO3(A=Ca,Sr)

Physical Review B ◽

10.1103/physrevb.68.045118 ◽

2003 ◽

Vol 68 (4) ◽

Author(s):

W.-D. Cheng ◽

H. Zhang ◽

D.-S. Wu ◽

D.-G. Chen ◽

H.-X. Wang

Keyword(s):

Optical Properties ◽

Electronic Structure ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Third Order ◽

Frequency Dependent

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Frequency dependent nonlinear optical properties of molecules

The Journal of Chemical Physics ◽

10.1063/1.451255 ◽

1986 ◽

Vol 85 (2) ◽

pp. 976-989 ◽

Author(s):

Hideo Sekino ◽

Rodney J. Bartlett

Keyword(s):

Optical Properties ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Frequency Dependent

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Coupled-cluster approach for studying the electronic and nonlinear optical properties of conjugated molecules

Physical Review B ◽

10.1103/physrevb.62.15452 ◽

2000 ◽

Vol 62 (23) ◽

pp. 15452-15460 ◽

Author(s):

Z. Shuai ◽

J. L. Brédas

Keyword(s):

Optical Properties ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Coupled Cluster ◽

Cluster Approach ◽

Conjugated Molecules

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