4.6 Article

Linear and nonlinear optical properties of triphenylamine-functionalized C-60: insights from theory and experiment

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PHYSICAL CHEMISTRY CHEMICAL PHYSICS
卷 12, 期 2, 页码 373-381

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ROYAL SOC CHEMISTRY
DOI: 10.1039/b917825b

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资金

  1. European Union [MTKD-CT-2006042488]
  2. Barcelona Supercomputing Center [QCM-2008-0027]
  3. Wroclaw Centre for Networking and Supercomputing (WCSS)
  4. Greek Ministry for Development (General Secretariat for Research and Technology) [PENED 2003]

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In the present study we report on the linear and nonlinear optical properties of C-60-triphenylamine (TPhA) hybrids. The synthesized materials were prepared following the 1,3-dipolar cycloaddition of azomethine ylides onto the skeleton of C-60 forming the TPhA-based monoadduct, equatorial bis-adduct and dumbell C-60. Complementary spectroscopic techniques, such as NMR, MALDI-TOF-MS, and ATR-IR are applied for the structural characterization of the hybrid materials, while intermolecular electronic interactions are investigated by UV-Vis measurements. In all considered cases, C-60 serves as an acceptor while the triphenylamine unit is chosen as a donor. In order to investigate the dependence of the second-order hyperpolarizability on the architecture of the systems (D-A, A-D-A) we use a Z-scan technique employing 532 nm, 35 ps laser pulses. We have found that the total second-order hyperpolarizability of the C-60-TphA-C-60 system is several times larger than that of TPhA-C-60. The results of experimental measurements are supported by quantum-chemical calculations.

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