Terahertz absorption spectra of benzene-1,2-diol, benzene-1,3-diol and benzene-1,4-diol
文献类型：期刊论文
| 作者 | Zheng, Zhuan-Ping ; Fan, Wen-Hui; Yan, Hui
|
| 刊名 | chemical physics letters
 |
| 出版日期 | 2012-02-16 |
| 卷号 | 525-26页码:140-143 |
| ISSN号 | 0009-2614 |
| 产权排序 | 1 |
| 合作状况 | 国内 |
| 中文摘要 | the terahertz spectra (8-128 cm(-1)) of three structural isomers have been measured using terahertz time-domain spectroscopy at room temperature. substantial differences among these thz spectra have been found and implied that thz-tds is an excellent tool to identify isomers. numerical calculation based on solid-state density functional theory has been carried out and assigned the observed thz features theoretically. good agreement between the calculated and experimentally measured spectra for benzene-1,2-diol and benzene-1,3-diol has been achieved. according to the calculated results, it is found that the measured thz spectra of these two isomers mainly originate from intermolecular vibrations. (c) 2011 elsevier b.v. all rights reserved. |
| 英文摘要 | the terahertz spectra (8-128 cm(-1)) of three structural isomers have been measured using terahertz time-domain spectroscopy at room temperature. substantial differences among these thz spectra have been found and implied that thz-tds is an excellent tool to identify isomers. numerical calculation based on solid-state density functional theory has been carried out and assigned the observed thz features theoretically. good agreement between the calculated and experimentally measured spectra for benzene-1,2-diol and benzene-1,3-diol has been achieved. according to the calculated results, it is found that the measured thz spectra of these two isomers mainly originate from intermolecular vibrations. (c) 2011 elsevier b.v. all rights reserved. |
| WOS标题词 | science & technology ; physical sciences |
| 学科主题 | chemistry ; physical ; physics ; atomic ; molecular & chemical |
| 类目[WOS] | chemistry, physical ; physics, atomic, molecular & chemical |
| 研究领域[WOS] | chemistry ; physics |
| 关键词[WOS] | density-functional theory ; time-domain spectroscopy ; vibrational-spectra ; polymorphs ; castep |
| 收录类别 | SCI |
| 语种 | 英语 |
| WOS记录号 | WOS:000300225900027 |
| 公开日期 | 2012-09-04 |
| 源URL | [http://ir.opt.ac.cn/handle/181661/20372]  |
| 专题 | 西安光学精密机械研究所_瞬态光学技术国家重点实验室 |
| 作者单位 | Chinese Acad Sci, Xian Inst Opt & Precis Mech, State Key Lab Transient Opt & Photon, Xian 710119, Peoples R China |
| 推荐引用方式 GB/T 7714 | Zheng, Zhuan-Ping,Fan, Wen-Hui,Yan, Hui. Terahertz absorption spectra of benzene-1,2-diol, benzene-1,3-diol and benzene-1,4-diol[J]. chemical physics letters,2012,525-26:140-143. |
| APA | Zheng, Zhuan-Ping,Fan, Wen-Hui,&Yan, Hui.(2012).Terahertz absorption spectra of benzene-1,2-diol, benzene-1,3-diol and benzene-1,4-diol.chemical physics letters,525-26,140-143. |
| MLA | Zheng, Zhuan-Ping,et al."Terahertz absorption spectra of benzene-1,2-diol, benzene-1,3-diol and benzene-1,4-diol".chemical physics letters 525-26(2012):140-143. |
入库方式： OAI收割
来源：西安光学精密机械研究所
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