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复杂晶体的化学键和非线性光学效应
作者姓名:张思远  薛冬峰
作者单位:中国科学院长春应用化学研究所稀土化学和物理开放实验室, 长春, 130022
基金项目:国家自然科学基金(29871029);长春应用化学中心资助
摘    要:系统地提出了复杂晶体化学键的介电理论方法,计算了一些非线性晶体的二阶极化系数dij。计算结果和实验值符合很好,同时表明这种方法不仅可应用于复杂晶体,还提供了材料设计的某些依据。

关 键 词:复杂晶体  化学键  非线性光学系数dij  
收稿时间:2000-11-13

Chemical Bond of Complex Structure Crystals and Nonlinear Optical Effect
Authors:Zhang Si-yuan  Xue Dong-feng
Institution:Laboratory of Rare Earth of Chemistry and Physics, Changchun Institute of Applied chmistry, Chinese Academy of Sciences, Changchun 130022
Abstract:A theoretical method on constituent chemical bonds of complex crystals based on the dielectric theory of solids has been proposed systematically, the independent nonlinear optical tensor co-efficients dij of some typical NLO cxystals with complex structures have been quantitatively calculated. Theoretical values agree with experimental data satisfactorily.This work shows that our method has a good application in dealing with optical nonlinearities of complex crystals, it also would be useful in designing or modifying new NLO crystal materials.
Keywords:complex crystals  chemical bond  nonlinear optical coefficient dij  
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