Calculations on nonlinear optical pr...
Gu, Feng Long.

 

  • Calculations on nonlinear optical properties for large systems[electronic resource] :the elongation method /
  • 紀錄類型: 書目-語言資料,印刷品 : Monograph/item
    杜威分類號: 535.2
    書名/作者: Calculations on nonlinear optical properties for large systems : the elongation method // by Feng Long Gu ... [et al.].
    其他作者: Gu, Feng Long.
    出版者: Cham : : Springer International Publishing :, 2015.
    面頁冊數: xvi, 93 p. : : ill. (some col.), digital ;; 24 cm.
    Contained By: Springer eBooks
    標題: Nonlinear optics.
    標題: Chemistry.
    標題: Theoretical and Computational Chemistry.
    標題: Optics and Electrodynamics.
    標題: Nanotechnology.
    標題: Protein Science.
    ISBN: 9783319110684 (electronic bk.)
    ISBN: 9783319110677 (paper)
    內容註: Survey of Nonlinear Optical Materials -- Quantum-Mechanical Treatment of Responses to Electric Fields Molecular Systems -- Quantum-Mechanical Treatment of Responses to Electric Fields Extended Systems -- The Elongation Method -- Applications of the Elongation Method to NLO Properties -- Future Prospects.
    摘要、提要註: For design purposes one needs to relate the structure of proposed materials to their NLO (nonlinear optical) and other properties, which is a situation where theoretical approaches can be very helpful in providing suggestions for candidate systems that subsequently can be synthesized and studied experimentally. This brief describes the quantum-mechanical treatment of the response to one or more external oscillating electric fields for molecular and macroscopic, crystalline systems. To calculate NLO properties of large systems, a linear scaling generalized elongation method for the efficient and accurate calculation is introduced. The reader should be aware that this treatment is particularly feasible for complicated three-dimensional and/or delocalized systems that are intractable when applied to conventional or other linear scaling methods.
    電子資源: http://dx.doi.org/10.1007/978-3-319-11068-4
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