溶剂在分子异构体形成和松弛中的作用

I. Deperasińska, E. Gaweda, M. Mandziuk, J. Prochorow
{"title":"溶剂在分子异构体形成和松弛中的作用","authors":"I. Deperasińska,&nbsp;E. Gaweda,&nbsp;M. Mandziuk,&nbsp;J. Prochorow","doi":"10.1016/0378-4487(82)80025-3","DOIUrl":null,"url":null,"abstract":"<div><p>The processes of formation and of relaxation of molecular exciplex in solution are discussed in the framework of method which incorporates solvent parameters into calculations of potential energy curves of different states attainable by exciplex system. An analysis of the results of calculations shows that intramolecular vibrations are serving as acceptors for energy dissipated by the system in the formation process and that this accepting ability can be modified by solvent polarity. It is also shown that the most important role is played by solvent in the relaxation of encounter complex to “equilibrium” exciplex.</p></div>","PeriodicalId":100049,"journal":{"name":"Advances in Molecular Relaxation and Interaction Processes","volume":null,"pages":null},"PeriodicalIF":0.0000,"publicationDate":"1982-05-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1016/0378-4487(82)80025-3","citationCount":"1","resultStr":"{\"title\":\"On the role of solvent in formation and relaxation of molecular exciplex\",\"authors\":\"I. Deperasińska,&nbsp;E. Gaweda,&nbsp;M. Mandziuk,&nbsp;J. Prochorow\",\"doi\":\"10.1016/0378-4487(82)80025-3\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>The processes of formation and of relaxation of molecular exciplex in solution are discussed in the framework of method which incorporates solvent parameters into calculations of potential energy curves of different states attainable by exciplex system. An analysis of the results of calculations shows that intramolecular vibrations are serving as acceptors for energy dissipated by the system in the formation process and that this accepting ability can be modified by solvent polarity. It is also shown that the most important role is played by solvent in the relaxation of encounter complex to “equilibrium” exciplex.</p></div>\",\"PeriodicalId\":100049,\"journal\":{\"name\":\"Advances in Molecular Relaxation and Interaction Processes\",\"volume\":null,\"pages\":null},\"PeriodicalIF\":0.0000,\"publicationDate\":\"1982-05-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"https://sci-hub-pdf.com/10.1016/0378-4487(82)80025-3\",\"citationCount\":\"1\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Advances in Molecular Relaxation and Interaction Processes\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/0378448782800253\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Advances in Molecular Relaxation and Interaction Processes","FirstCategoryId":"1085","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/0378448782800253","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 1

摘要

在将溶剂参数纳入共轭体系不同状态势能曲线计算的方法框架下,讨论了分子共轭体系在溶液中的形成过程和弛豫过程。对计算结果的分析表明,分子内振动是系统在形成过程中耗散能量的受体,并且这种接受能力可以通过溶剂极性来改变。研究还表明,溶剂在遇络合物弛豫到“平衡”外络合物的过程中起着最重要的作用。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
查看原文
分享 分享
微信好友 朋友圈 QQ好友 复制链接
本刊更多论文
On the role of solvent in formation and relaxation of molecular exciplex

The processes of formation and of relaxation of molecular exciplex in solution are discussed in the framework of method which incorporates solvent parameters into calculations of potential energy curves of different states attainable by exciplex system. An analysis of the results of calculations shows that intramolecular vibrations are serving as acceptors for energy dissipated by the system in the formation process and that this accepting ability can be modified by solvent polarity. It is also shown that the most important role is played by solvent in the relaxation of encounter complex to “equilibrium” exciplex.

求助全文
通过发布文献求助,成功后即可免费获取论文全文。 去求助
来源期刊
自引率
0.00%
发文量
0
期刊最新文献
Editorial Ab initio SCF-MO study of hydrogen bonding in benzene…HF C-13 magnetic relaxation rates and H-1 and C-13 paramagnetic shifts of Co(II) complex of dopamine The study of self-diffusion in liquids by means of NMR Structure of molecular and ionic H-bonded complexes of Hexamethylphosphortriamide by low temperature NMR in freon solution
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
现在去查看 取消
×
提示
确定
0
微信
客服QQ
Book学术公众号 扫码关注我们
反馈
×
意见反馈
请填写您的意见或建议
请填写您的手机或邮箱
已复制链接
已复制链接
快去分享给好友吧!
我知道了
×
扫码分享
扫码分享
Book学术官方微信
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术
文献互助 智能选刊 最新文献 互助须知 联系我们:info@booksci.cn
Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。
Copyright © 2023 Book学术 All rights reserved.
ghs 京公网安备 11010802042870号 京ICP备2023020795号-1