Zeolitic Imidazolate Frameworks as H2 Adsorbents: Ab Initio Based Grand Canonical Monte Carlo Simulation

2010 ◽  
Vol 114 (27) ◽  
pp. 12039-12047 ◽  
Author(s):  
Sang Soo Han ◽  
Seung-Hoon Choi ◽  
William A. Goddard
Keyword(s):  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Ab Initio ◽  
Grand Canonical Monte Carlo ◽  
Zeolitic Imidazolate Frameworks ◽  
Grand Canonical

scholarly journals Adsorption of Thiophene in MCM-22 Zeolite by Grand Canonical Monte Carlo Simulation

2013 ◽  
Vol 25 (2) ◽  
pp. 1011-1014 ◽  
Author(s):  
Li-Chun Xuan ◽  
Ming-Xia Li ◽  
Qing-Jiang Pan ◽  
Guo Zhang
Keyword(s):  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Grand Canonical Monte Carlo ◽  
Grand Canonical
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