搜索结果: 1-2 共查到“化学 n-alkanes”相关记录2条 . 查询时间(0.046 秒)
Activation of Light Alkanes on Pure and Fe and Al Doped Silica Clusters: A Density Functional and ONIOM Study
C-H bond activation methane ethane, silica Fe doping Al doping density functional DFT ONIOM
2010/4/16
C-H bond activation was studied by use of density functional theory (DFT) and ONIOM calculations as implemented in Gaussian 2003 at the B3LYP level utilising 6-31G* as the basis set for Si, Al, and Fe...
Vapour Liquid Equilibrium in Asymmetric Mixtures of n-Alkanes with Ethane
Vapour liquid equilibrium Interaction parameters Asymmetric mixtures
2010/4/22
The paper presents a vapour liquid equilibria study in binary mixtures of n-alkanes with high dimensional asymmetry. Each mixture contains ethane and alkanes higher than eicosane. Calculations were do...