Warianty tytułu
Konferencja
IV International Conference Catalysis and Adsorption in Fuel Processing and Environmental Protection, September 18-21, 2002, Kudowa Zdrój, Poland
Języki publikacji
Abstrakty
Rapidly growing computational power of computers and corresponding development of scientific software allows more accurate simulations of catalytic systems. Results of computer experiments are very helpful in understanding the catalytic process. Present work is dedicated to analysis of catalytic behavior of Pt-Sn/g-Al2O3 system. Different computational methods such as Molecular Dynamics and Grand Canonical Monte Carlo were used in calculations. Techniques chosen for sorption simulations allowed evaluating such properties as energy of adsorption, location of adsorption centers or adsorption isotherms. In case of diffusive properties diffusion coefficients and their dependency on temperature were evaluated.
Słowa kluczowe
Czasopismo
Rocznik
Tom
Strony
109-114
Opis fizyczny
Bibliogr. 5
Twórcy
autor
autor
autor
- Institute of Chemistry and Technology of Petroleum and Coal, Wrocław University of Technology, ul. Gdańska 7/9, Wrocław 50-344, Poland
Bibliografia
Typ dokumentu
Bibliografia
Identyfikatory
Identyfikator YADDA
bwmeta1.element.baztech-article-BPW6-0001-0080