{"title":"AB initio interaction polarizabilities and pair potentials for the ion pairs Li+…Br−, Na+…Br−, K+…Br− and Br−","authors":"Alan Hinchliffe","doi":"10.1016/0378-4487(82)80010-1","DOIUrl":null,"url":null,"abstract":"<div><p>Pair potentials and polarizabilities of LiBr, NaBr, KBr and Br<sub>2</sub><sup>2−</sup> have been computed over a range of internuclear separations R using the gaussian orbital SCF-MO method. Together with results previously reported for all other ion pairs, the present values form a complete and consistent set of energy and polarizability data on the bromides of lithium, sodium and potassium.</p></div>","PeriodicalId":100049,"journal":{"name":"Advances in Molecular Relaxation and Interaction Processes","volume":null,"pages":null},"PeriodicalIF":0.0000,"publicationDate":"1982-04-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1016/0378-4487(82)80010-1","citationCount":"3","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Advances in Molecular Relaxation and Interaction Processes","FirstCategoryId":"1085","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/0378448782800101","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 3
Abstract
Pair potentials and polarizabilities of LiBr, NaBr, KBr and Br22− have been computed over a range of internuclear separations R using the gaussian orbital SCF-MO method. Together with results previously reported for all other ion pairs, the present values form a complete and consistent set of energy and polarizability data on the bromides of lithium, sodium and potassium.
京公网安备 11010802042870号
京ICP备2023020795号-1
分享
求助内容：
应助结果提醒方式：
扫码关注我们
