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Bond strength of non-equivalent hybridization and the maximum overlap method

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成果类型:
期刊论文
作者:
HU, ZM*;LIU, F;FAN, L
通讯作者:
HU, ZM
作者机构:
Department of Chemistry, Central China Normal University, WuhanPeople's Republic of China
通讯机构:
[HU, ZM] C
CENT CHINA NORMAL UNIV, DEPT CHEM, WUHAN, PEOPLES R CHINA.
语种:
英文
期刊:
Journal of Molecular Structure: THEOCHEM
ISSN:
0166-1280
年:
1990
卷:
205
页码:
151-157
机构署名:
本校为第一且通讯机构
院系归属:
化学学院
摘要:
With the assumptions that the radial dependence of the atomic orbitais (AO) is ignored and that the projection method is employed, a general procedure is presented for the discussion of hybridization and bond strength based on the maximum overlap method (MOM). The procedure was used for the non-equivalent hybrid atomic orbitais (HAO) in ML4 systems. The formulae of the bond strength according to Pauling are derived and the connection between the equivalent and non-equivalent hybrids is discussed. In combination with the results of previous work, it is shown that there is total coincidence betw...

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