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On the understanding of gas adsorption in nano-porous materials via molecular simulation

作者:来源:山东理工|彩吧论坛发布时间:2019-12-25阅读次数:10

 

    今邀请澳大利亚昆士兰|彩吧论坛范春艳博士来我校进行学术访问并作学术报告,届时将与我校有关专家学者进行学术交流。欢迎广大师生踊跃参加!

   报告题目:On the understanding of gas adsorption in nano-porous materials via molecular simulation

    报告时间:20191227日(周五)下午2:30

    报告地点:13号教学楼404

 

    附件:范春艳博士简介

 

                       化学化工|彩吧论坛

                       科学技术处

                          20191225

 

附件

 

范春艳博士简介


    范春艳,澳大利亚昆士兰|彩吧论坛化学工程博士,现任澳大利亚科廷|彩吧论坛化学工程高级讲师,主  要研究方向为物理科学和工程学中各种吸附现象的一基本机理研究。范春艳博士在Chemical Engineering ScienceChemical Engineering Journal等国际知名化工领域期刊发表了40多篇高水平文章,并获得了澳大利亚研究委员会的一Discovery Early Career Research Award2016)和科廷|彩吧论坛Pro Vice Chancellor's Early Career Research Award2015)。目前,范春艳博士正在主  持一项澳大利亚研究委员会的一科研项目,资助金额为30万澳元。

    报告摘要:Adsorption process is widely used in many applications in industries, e.g. removal of unwanted impurities, gases separations, etc. To further improve existing processes or develop new technologies in the relevant fields, it is essential to understand the underlying mechanisms of various adsorption phenomena observed experimentally. This could be realized through the Molecular Simulation, which has emerged as a powerful tool in providing the microscopic insight into the various interactions within a given system, with the advances in computer software and hardware. In this presentation, Monte Carlo simulation is employed to investigate systematically the adsorption behaviour of gases in nano-porous materials, ranged from the adsorption isotherms, hysteresis, isosteric heat, to the adsorption induced deformation, with bringing the effects of force field, pore geometry, temperature, etc. into consideration.


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