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	Ab Initio Computational Method for Classical Valence Bond Theory
	Su Peifeng ; Su PF(苏培峰) ; Wu Wei ; Wu W(吴玮)
	2012-06-24
关键词	ab initio VB methodology development complicated systems
英文摘要	In 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.
语种	英语
出版者	CHINESE ACAD SCIENCES
内容类型	期刊论文
源URL	[http://dspace.xmu.edu.cn/handle/2288/15245]
专题	化学化工－已发表论文
推荐引用方式 GB/T 7714	Su Peifeng,Su PF,Wu Wei,et al. Ab Initio Computational Method for Classical Valence Bond Theory[J],2012.
APA	Su Peifeng,苏培峰,Wu Wei,&吴玮.(2012).Ab Initio Computational Method for Classical Valence Bond Theory..
MLA	Su Peifeng,et al."Ab Initio Computational Method for Classical Valence Bond Theory".(2012).

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