A quasi elastic neutron scattering and molecular dynamics study of the rotational diffusion of n- and iso-alkanes in the cages of zeolite MCM-22

摘要：

Quasi elastic neutron scattering experiments were performed to study diffusion of n-pentane and 2-methyl butane in zeolite MCM-22. Differences in rotational diffusion between the linear and branched chains in the supercages of the zeolites were measured. The smaller radius of gyration of the branched chain compared to its linear isomer results in a less restricted rotation in the zeolite cages as shown by molecular dynamics simulations.

作者: Shiping Huang Vincent Finsy Mark T. F. Telling Gino V. Baron Joeri F. M.Denayer

作者单位: Department of Chemical Engineering, Vrije Universiteit Brussel, Pleinlaan 2, B-1050 Brussel, Belgium ISIS Facility, Rutherford Appleton Laboratory, Chilton, OXON, OX11 0QX, UK

会议类型: 国际会议

会议名称: 第15届国际分子筛大会

会议地点: 北京

会议语种:英文

在线出版日期: 2007-08-12（万方平台首次上网日期，不代表论文的发表时间）