{"title":"一种简化色散力描述的新约束","authors":"J. Dobson, Bradley P. Dinte, Jun Wang, T. Gould","doi":"10.1071/PH00046","DOIUrl":null,"url":null,"abstract":"We propose a novel use of an exact constraint in the construction of simple approximations for response functions of interacting many-electron systems. Within its simplest local version, the resulting theory gives improved approximations for static atomic dipolar polarisabilities without the direct use of wavefunctions or semi-empirical cutoffs. It leads to correct van der Waals energies between distant planar systems, but over-corrects existing cutoff theories for the van der Waals C 6 coefficient for atoms. It is argued that a nonlocal-response version of the constrained theory will do better.","PeriodicalId":170873,"journal":{"name":"Australian Journal of Physics","volume":"9 1","pages":"0"},"PeriodicalIF":0.0000,"publicationDate":"2000-08-15","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"7","resultStr":"{\"title\":\"A Novel Constraint for the Simplified Description of Dispersion Forces\",\"authors\":\"J. Dobson, Bradley P. Dinte, Jun Wang, T. Gould\",\"doi\":\"10.1071/PH00046\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"We propose a novel use of an exact constraint in the construction of simple approximations for response functions of interacting many-electron systems. Within its simplest local version, the resulting theory gives improved approximations for static atomic dipolar polarisabilities without the direct use of wavefunctions or semi-empirical cutoffs. It leads to correct van der Waals energies between distant planar systems, but over-corrects existing cutoff theories for the van der Waals C 6 coefficient for atoms. It is argued that a nonlocal-response version of the constrained theory will do better.\",\"PeriodicalId\":170873,\"journal\":{\"name\":\"Australian Journal of Physics\",\"volume\":\"9 1\",\"pages\":\"0\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2000-08-15\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"7\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Australian Journal of Physics\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.1071/PH00046\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Australian Journal of Physics","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.1071/PH00046","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
A Novel Constraint for the Simplified Description of Dispersion Forces
We propose a novel use of an exact constraint in the construction of simple approximations for response functions of interacting many-electron systems. Within its simplest local version, the resulting theory gives improved approximations for static atomic dipolar polarisabilities without the direct use of wavefunctions or semi-empirical cutoffs. It leads to correct van der Waals energies between distant planar systems, but over-corrects existing cutoff theories for the van der Waals C 6 coefficient for atoms. It is argued that a nonlocal-response version of the constrained theory will do better.