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单晶Ni(Pyrazole)_4X_2(X=C1,Br)的光谱研究
引用本文:杨复兴,鲁邦德,蒋光和,颜占先.单晶Ni(Pyrazole)_4X_2(X=C1,Br)的光谱研究[J].吉首大学学报(自然科学版),1994(5).
作者姓名:杨复兴  鲁邦德  蒋光和  颜占先
摘    要:本文利用d8(D2h*)全组态强场近似理论,对单晶Ni(pyrazole)4X2(X=C1,Br)型化合物的光谱进行了理论计算,计算结果与实验符合较好。

关 键 词:Ni(pyrazole)_4X_2  能量矩阵  光谱  D_(2h)分子对称性

A STUDY OF THE SPECTRUM FOR THE SINGLE CRYSTAL COMPOUND Ni(Pyrazole)_4X_2 (X=C1, Br)
Yang Fuxing, Lu Bangde, Jiang Guanghe, Yan zhanxian.A STUDY OF THE SPECTRUM FOR THE SINGLE CRYSTAL COMPOUND Ni(Pyrazole)_4X_2 (X=C1, Br)[J].Journal of Jishou University(Natural Science Edition),1994(5).
Authors:Yang Fuxing  Lu Bangde  Jiang Guanghe  Yan zhanxian
Institution:Department of Physics
Abstract:By means of complete configuration strong field approximate theory for d8 (D24 ),The spectrum of the single crystal compound Ni (pyrazole)4X2 (x = C1, Br )have been calculated theoretlcally in this paper. This result agree better with the experimental value.
Keywords:Ni(pyrazole)_2X_2  Energy matrix  Spectrum  D_(2h) molecular symmetry
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