The results show that the conductivities of C32 mainly concentrate on the molecular shell, and the electronic transmission on the inner surface is similar to that on the outside surface.
说明了C32分子器件的电子传输主要集中于C32分子的壳表上，并且分子球的内侧和外侧的电子传输相近似。
Using the electron microscope, the molecular structure of both SZLF and DALF could be observed showing that both proteins consisted of a protein shell and iron core.
电子显微镜技术揭示了SZLF和DALF的分子结构，阐明了两者蛋白均由蛋白壳和铁核组成。
By calculating the number of valence electron shell, we can gain the geometry array of the electronic pair, and then judge the molecular structures.
计算出价层电子对数，得到电子对的几何排布，从而判断出分子的几何构型。
The isospin dependent quantum molecular dynamics model has been further developed by considering shell effect and the fusion mechanism near Coulomb barrier is studied by using the improved model.
通过考虑动力学中的壳效应，对同位旋相关的量子分子动力学模型做了进一步改进，并利用改进的量子分子动力学模型对近垒熔合机制做了动力学研究。
This paper analyzes shell electron pair repulsion theory , valence-bond theory and molecular orbital theory on molecular structure of noble gas compounds.
对稀有气体化合物的分子结构分别用“价层电子对互斥理论”、“价键理论”和“分子轨道理论”进行了分析处理。
The computing formulae of the Young's moduli of SWCNT are obtained by comparing the total molecular potential energy of a SWCNT with the strain energy of a corresponding cylindrical thin shell.
然后通过总势能与相应薄圆柱壳的应变能比较，推导出了单壁碳纳米管杨氏模量的计算公式。
Therefore, it is shown that shell-model molecular dynamics simulation at constant pressure indeed provides a useful tool for studying the melting temperatures of other materials under high pressures.
因此，常压下壳层模型分子动力学方法为研究物质熔化提供了一个很好的方法。
The spatial configurations and bonding effects of Oxides of Nitrogen were explained by using the Valence-shell Electron Repulsion Theory, Hybrid-orbital Theory and Molecular orbital Theory.
用杂化轨道理论和分子轨道理论阐明了氮的氧化物成键类型，给出了分子空间构型及结构数据的解释。
The spatial configurations and bonding effects of Oxides of Nitrogen were explained by using the Valence-shell Electron Repulsion Theory, Hybrid-orbital Theory and Molecular orbital Theory.
用杂化轨道理论和分子轨道理论阐明了氮的氧化物成键类型，给出了分子空间构型及结构数据的解释。
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