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玻璃和晶体粉末样品的核磁共振谱的计算机拟合
引用本文:章宪权,吴肖令,邬学文.玻璃和晶体粉末样品的核磁共振谱的计算机拟合[J].波谱学杂志,1988,5(2):129-140.
作者姓名:章宪权  吴肖令  邬学文
作者单位:1. 上海交通大学;2. 华东师范大学
摘    要:文本介绍了存在各向异性化学位移效应和电四极矩相互作用时,自旋为半整数核的固体NMR中心跃迁粉末谱的计算机拟合方法,讨论了谱拟合步骤和模拟谱中的"噪声"和误差。

关 键 词:计算机拟合  玻璃态  粉末样品  核磁共振  粉末谱  
收稿时间:1987-06-11

COMPUTER SIMULATION OF NUCLEAR MAGNETIC RESONANCE SPECTRA OBSERVED IN GLASS AND POWDER SAMPLES
Zhang Xiangquan.COMPUTER SIMULATION OF NUCLEAR MAGNETIC RESONANCE SPECTRA OBSERVED IN GLASS AND POWDER SAMPLES[J].Chinese Journal of Magnetic Resonance,1988,5(2):129-140.
Authors:Zhang Xiangquan
Institution:1. Shanghai Jiao Tong University;2. East-China Normal University
Abstract:The computer simulation method of the solid powder pattern in the presence of anisotropic chemical shift effect and nuclear electric quadrupole interaction is presented. The computer program was designed for the powder pattern of the central transition of nuclei with half-integral spin. The "noise" and error in the simulation spectra as well as the spectra simulation procedure were analysed.
Keywords:Computer Simulation  Glass state  Powder Sample  NMR  Powder pattern  
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