| 晶体化学键的介电理论及其应用 |
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| 引用本文： | 高发明,高丽华.晶体化学键的介电理论及其应用[J].燕山大学学报,2011,35(3):189-197. |
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| 作者姓名： | 高发明 高丽华 |
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| 作者单位： | 燕山大学环境与化学工程学院,河北秦皇岛,066004 |
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| 基金项目： | 国家自然科学基金资助项目(21071122); 河北省自然科学基金资助项目(09965116D,E2010001169) |
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| 摘 要： | 基于复杂晶体化学键的介电理论,提出了晶体的化学键参数、硬度、同质异能位移和非线性光学系数等物理量的计算方法。这些方法建立起了化学键与各宏观性质之间的定量关系,并适用于多种类型物质的计算。
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| 关 键 词： | 化学键 硬度 同质异能位移 非线性光学系数 |
Dielectric theory of chemical bond in crystals and its application |
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| GAO Fa-ming,GAO Li-hua.Dielectric theory of chemical bond in crystals and its application[J].Journal of Yanshan University,2011,35(3):189-197. |
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| Authors: | GAO Fa-ming GAO Li-hua |
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| Institution: | GAO Fa-ming,GAO Li-hua(College of Environmental and Chemical Engineering,Yanshan University,Qinhuangdao,Hebei 066004,China) |
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| Abstract: | Based on the dielectric theory of chemical bond in crystals,the calculation methods for bond parameters,hardness,isomer shifts and nonlinear optical coefficients of crystals are proposed.These methods establish a link between chemical bond and macroscopic properties,and offer the advantage of applicability to a broad class of materials. |
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| Keywords: | chemical bond hardness isomer shift nonlinear optical coefficient |
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