frontier molecular orbital

常见例句

The result is explained qualitatively with the theory of frontier molecular orbital.
根据前线分子轨道理论，对实验结果提出了定性的解释。
Between electron density distribution of molecular frontier orbital energy and the substitute position, there were some dependencies.
发现前线轨道能量与分子的电子密度分布及取代位置均有一定依赖关系。
We have accurately determined the coupling constant between the molecule and electrodes by using the frontier molecular orbital theory and the perturbation method.
利用分子前线轨道理论和微扰方法定量地确定了分子与金属的相互作用能参数。