Simple Lattice Model for Solvation of Nonpolar Molecules in Hydrogen-Bonded Liquids

2000 ◽  
Vol 104 (28) ◽  
pp. 6653-6661 ◽  
Author(s):  
Charles D. Eads
2001 ◽  
Vol 115 (11) ◽  
pp. 5331-5337
Author(s):  
G. L. Aranovich ◽  
M. D. Donohue

2004 ◽  
Vol 272-276 ◽  
pp. 703-704 ◽  
Author(s):  
Eduard Vives ◽  
Xavier Illa ◽  
Antoni Planes

1998 ◽  
Vol 1 (3) ◽  
pp. 137-140 ◽  
Author(s):  
Eric Goles ◽  
Gregorio González ◽  
Hans Herrmann ◽  
Servet Mart´inez

2020 ◽  
Vol 7 (4) ◽  
pp. 004-011
Author(s):  
O. S. Solovyeva ◽  
◽  
V. A. Gorbunov ◽  
A. V. Myshlyavtsev ◽  
◽  
...  

In this paper, a simple lattice model of the metal-organic adsorption layer of 1,3,5- tris(pyridyl)benzene and copper on the surface of Ti2CO2 was proposed. In this model, the selfassembly of the organometallic layer is considered as a one-component system that implicitly includes metal adatoms. The ground state phase diagram is calculated. A Monte Carlo simulation is performed using the Metropolis algorithm and the parallel temperature technique. The isotherm of the metal-organic is calculated at T = 300 K. All the results indicate the possibility of the formation of stable metal-organic phases on the Ti2CO2 surface.


1994 ◽  
Vol 6 (11) ◽  
pp. 2129-2136 ◽  
Author(s):  
M Dijkstra ◽  
J -P Hansen ◽  
A Meroni

AIChE Journal ◽  
1995 ◽  
Vol 41 (4) ◽  
pp. 954-958 ◽  
Author(s):  
Eamonn M. O'Toole ◽  
Rajesh Venkataramani ◽  
Athanassios Z. Panagiotopoulos

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