bond order meaning in English
键次
键级
键序
Examples
- The bond orders , net charges and the composition of molecular orbitals are calculated for the simplified ca3co409 model
简化的ca _ 3co _ 4o _ 9模型的键级、净电荷和分子轨道组成用相同的方法进行计算。 - So we figured that the influence of the electron - electron interactions must be considered in our work . added an electron - electron interaction ( up to the fourth neighbor ) term to the baranowski - buttner - voit ( bbv ) model for polyaniline , we carried out a self - consistent - variation calculation for an biexciton in the pernigranlilne - base polymer , in order to confirm the model hamiltonian . the results showed that two peaks ( near l . oev and 1 . 5ev ) appeared in the calculated optical absorption , besides the reproduced electronic structure , bond order wave ( bow ) and ring - torsion angles
发现引入电子?电子相互作用后，聚苯胺静态激子的性质受到影响，该聚合物的键序波、芳环扭角和电子中文摘要结构发生了变化，而且在理论吸收谱的低能端出现了明显的二特征吸收峰( 1 . 0ev和1 . 5ev附近) ，这一结果与实验数据很好的吻合，从而这一点表明我们所考虑的因素是合理的。