Molecular Simulation For Gas Adsorption At Tio2(Rutile And Anatase) Surface(2001)

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篇名	Molecular Simulation For Gas Adsorption At Tio2(Rutile And Anatase) Surface(2001)
並列篇名	Beautifully Islam: The Rise of “Hijabers Community” and Affective Agency in Central Java
作者	Hsin-Fu Lin (Hsin-Fu Lin)、Hong-Ming Lin (Hong-Ming Lin)
英文摘要	Several studies on synthesis, characteristics, and properties of Nanocrystalline(NC) TiO2 particles have been published [1-3]. Titanium dioxide has been used in a great variety of applications also. The purpose of this study is to build the database for multi-functioning nanocrystalline gas sensors and good selectivity. In this study, to evaluate adsorption properties of NC rutile or anatase TiO2 particle in this study, molecular simulation is employed to calculate the binding energies of CO gas on TiO2 surface at different temperatures and pressures.
起訖頁	55-55
刊名	國家高速網路與計算中心年報
期數	200201 (2001期)
出版單位	財團法人國家實驗研究院國家高速網路與計算中心
該期刊-上一篇	Intramolecular Electron Transfer Rate Calculations(2001)
該期刊-下一篇	An Ab initio Study of Dissociative Photoionization of Trichloromethylsilane(2001)