共价键
电子密度
化学键
电子
债券
键能
电子定域函数
原子物理学
化学
弯键
六重键
材料科学
计算化学
分子物理学
债券定单
结晶学
物理
粘结长度
分子
量子力学
有机化学
财务
经济
晶体结构
作者
Dieter Cremer,Elfi Kraka
标识
DOI:10.1002/anie.198406271
摘要
Formation of a covalent bond is not necessarily associated with an increase in electron density in the bonding region. This can be established by analysis of the single electron density distributions ρ( r ) with the aid of the assigned Laplace field ▽ 2 ρ( r ). For “bonds without bonding electron density ρ( r )”, it is decisive that the density ρ( r ) actually present in the region between the atoms results in a decrease in the local energy density and, hence, produces a stabilizing effect.
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