| 多晶顺磁共振谱的拟合 |
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| 引用本文： | 陈振涛,孙琼丽.多晶顺磁共振谱的拟合[J].结构化学,1993,12(6):424-429. |
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| 作者姓名： | 陈振涛 孙琼丽 |
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| 作者单位： | 中国科学院福建物质结构研究所，中国科学院福建物质结构研究所，中国科学院福建物质结构研究所 福州结构化学国家重点实验室 福州 350002，福州结构化学国家重点实验室 福州 350002，福州结构化学国家重点实验室 福州 350002 |
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| 摘 要： | 对电子自旋1/2≤S<3.5,核自旋1/2≤I<4.5和配体少于10个的顺磁体系的多晶EPR谱的拟合进行研究。在VAX-11/785计算机上用FORTRAN语言建立EPR谱模拟程序包,计算了多个例子,获得较为满意的结果。
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| 关 键 词： | 计算机模拟 电子自旋共振 多晶 |
The Computer Simulations of Electronic Paramagnetic Resonance (EPR) for Poly crystal line Systems |
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| Chen Zhen-Tao Sun Qiong-Li Huang Xin.The Computer Simulations of Electronic Paramagnetic Resonance (EPR) for Poly crystal line Systems[J].Chinese Journal of Structural Chemistry,1993,12(6):424-429. |
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| Authors: | Chen Zhen-Tao Sun Qiong-Li Huang Xin |
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| Abstract: | The EPR for the polycrystalline systems with their electronic and nuclear spin quantum numbers in the ranges of 1/2≤S<3.5 and 1/2≤I<4.5 respectively can be simulated by using our simulation programm which is performed on a VAX-11/785 computer.The language used is FORTRAN by which the programm packages have been established for the simulation.A few typical examples are provided to display the results well simulated. |
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| Keywords: | Computer simulations Electronic paramagnetic resonance Poly crystal line |
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