在Origin7.0中实现化合物红外光谱数据可视化  

Making Chemical Compound IR Spectrum Data Visualized in Origin 7.0 Sofeware

作　　者：李林[1] 孙元喜[1] 何旭元[1] 

机构地区：[1]湖南文理学院化学化工系,湖南常德415000

出　　处：《分析测试技术与仪器》2006年第4期199-201,共3页Analysis and Testing Technology and Instruments

基　　金：湖南省教育厅科研课题(06C571);重点学科建设基金(光学)

摘　　要：介绍如何利用数学软件Origin7.0及其插件对含有化合物红外光谱信息的数据文件进行可视化,并对视图予以编辑,以获得峰值标注选择性好、精确度高的可用于化合物结构解析的红外光谱图,以及实现化合物红外光谱数据可视化的一般过程与特点.A method of employing Origin 7.0 software and its Add--ons to make the data containing the information of infrared spectrum of chemical compound visualization was proposed. Then the yielded views were edited to give the infrared spectrum figures of chemical compound in which peaks were picked （labelled） with good selectivity and high accuracy for structure characterization of chemical compound.Through this paper, we can be familiar with the general processes and characteristics of using Origin 7.0 to realize the data visualization containing the information of infrared spectrum of chemical compound.

关 键 词：红外光谱 ORIGIN 7.0 插件 数据可视化 峰值标注 

分 类 号：O657.3[理学—分析化学]