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分别利用因子群对称分析法和位置群对称分析法对Ca3(BO3)2晶体的振动模式进行了理论分析.Ca3(BO3)2的晶格振动模式分为外振动和内振动模式,外振动模式为:3A1g+4A2g+7Eg+3A1u+3A2u+6Eu,内振动模式为:2A1g+2A2g+4Eg+2A1u+2A2u+4Eu.Ca3(BO3)2晶体在布里渊区中心Γ点晶格振动的对称性分类为:5A1g+6A2g+11Eg+5A1u+6A2u+11Eu,其中声学模为:A2u+Eu,拉曼活性光学模为:5A1g+11Eg,红外活性光学模为:5A2u+10Eu,其余为非拉曼、非红外活性光学振动模.用高温固相法成功合成了Ca3(BO3)2粉末,测量了它的室温Raman光谱,并利用群论分析的结果对谱图进行了讨论,指认了BO3-3基团的特征振动频率.

参考文献

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