2014•Computational and Theoretical ChemistryRequires access

Quantum chemistry study on nonlinear optical properties of hemicyanine dye derivatives with different electron donor groups

Kui Han, Haipeng Li, Xiaopeng Shen, Gang Tang, Yingying Chen, Zhaohui Zhang

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Key concepts: Hyperpolarizability, Chemistry, Time-dependent density functional theory, HOMO/LUMO, Density functional theory, Molecular orbital, Excited state, Computational chemistry

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Quantum chemistry study on nonlinear optical properties of hemicyanine dye derivatives with different electron donor groups — Research Paper | ScholarLens