Title of article
Grand canonical Monte Carlo simulation of the adsorption of CO2 on silicalite and NaZSM-5
Author/Authors
Akiyasu Hirotani، نويسنده , , Koichi Mizukami، نويسنده , , Ryuji Miura، نويسنده , , Hiromitsu Takaba، نويسنده , , Takeshi Miya، نويسنده , , Adil Fahmi، نويسنده , , Andra´s Stirling، نويسنده , , Momoji Kubo ، نويسنده , , Akira Miyamoto ، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 1997
Pages
4
From page
81
To page
84
Abstract
The adsorption of carbon dioxide in silicalite and NaZSM-5 zeolite has been studied using new Monte Carlo software. In
this program, sodium cations and framework are movable during the simulation. The calculated adsorption isotherms are in
good agreement with the experimental results. The energy distribution of carbon dioxide over silicalite and NaZSM-5 shows
that the increase of the adsorption energy for NaZSM-5 is mainly due the electric field generated by sodium cations. q1997
Elsevier Science B.V.
Keywords
silicalite , NaZSM-5 , Monte Carlo simulation , CO2 , adsorption
Journal title
Applied Surface Science
Serial Year
1997
Journal title
Applied Surface Science
Record number
991955
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