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dc.contributor.authorSu Peifeng
dc.contributor.author苏培峰
dc.contributor.authorWu Wei
dc.contributor.author吴玮
dc.date.accessioned2013-03-21T02:56:26Z
dc.date.available2013-03-21T02:56:26Z
dc.date.issued2012-06-24
dc.identifier.citationPROGRESS IN CHEMISTRY,2012,24(6):1001-1007zh_CN
dc.identifier.issn1005-281X
dc.identifier.uriWOS:000306379200010
dc.identifier.urihttps://dspace.xmu.edu.cn/handle/2288/15245
dc.description.abstractIn modern quantum chemistry, valence bond (VB) theory and molecular orbital (MO) theory are the two general theoretical approaches for chemical bonding. VB theory provides clear interpretation and chemical insights by employing covalent and ionic VB structures explicitly. This review focuses on the methodology development of the current modern classical VB methods in the improvement of computational accuracy and the extension of application areas. Moreover, the further development of modern classical VB methods is briefly prospected.zh_CN
dc.language.isoenzh_CN
dc.publisherCHINESE ACAD SCIENCESzh_CN
dc.subjectab initio VBzh_CN
dc.subjectmethodology developmentzh_CN
dc.subjectcomplicated systemszh_CN
dc.titleAb Initio Computational Method for Classical Valence Bond Theoryzh_CN
dc.typeArticlezh_CN


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