Dynamics Studies on Molecular Diffusion in Zeolites

A review about the applications of molecular dynamics（MD）simulation in zeolites is presented. MD simulation has been proved to be a useful tool due to its applications in this field for the recent two decades. The fundamental theory of MD is introduced and the hydrocarbon diffusion in zeolites is mainly focused on in this paper.

作 者： 王秋霞 樊建芬 肖鶴鳴   作者單位： 王秋霞,樊建芬(Department of Chemistry, Suzhou University, Suzhou, Jiangsu 215006, China)

肖鶴鳴(Department of Chemistry, Nanjing University of Science and Technology, Nanjing, Jiangsu 210094, China) 

刊 名： 結(jié)構(gòu)化學(xué)  ISTIC SCI PKU 英文刊名： CHINESE JOURNAL OF STRUCTURAL CHEMISTRY  年，卷(期)： 2003 22(4)  分類號(hào)： O64  關(guān)鍵詞： molecular dynamics   zeolite   molecular diffusion  

【Dynamics Studies on Molecular Diffus】相關(guān)文章：

Molecular recognition studies on supramolecular systems (XXIV) --Conformations and complexation abilities of chemically04-30

Molecular recognition studies on supramolecular systems (XXIV) --Conformations and complexation abilities of chemically04-30

Epidemic dynamics on complex networks04-28

Epidemic dynamics on complex networks04-29

Molecular Evidences for the Biosynthesis of Pederin by Endosymbiont04-28

Applications of the molecular orbital graph theory (XI)--The molecular moments method of evaluating π-bond grade and jud04-30

Applications of the molecular orbital graph theory (XI)--The molecular moments method of evaluating π-bond grade and jud04-30

International Conference on Land Use / Cover Change Dynamics04-28

Studies on RFQ accelerators and its applications04-28

Chinese Studies Librarianship in North America04-27