adsorption on heterogeneous surfaces
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2019 ◽  
Vol 21 (46) ◽  
pp. 25558-25568 ◽  
Author(s):  
Srikanth Ravipati ◽  
Amparo Galindo ◽  
George Jackson ◽  
Andrew J. Haslam

A FEA mapping procedure for providing coarse-grained, two-body fluid–solid potentials (describing the interaction between a fluid molecule and a solid surface) is investigated, and adapted to allow study of adsorption on heterogeneous surfaces.


2011 ◽  
Vol 29 (7) ◽  
pp. 613-627 ◽  
Author(s):  
P.M. Centres ◽  
F. Bulnes ◽  
J.L. Riccardo ◽  
A.J. Ramirez-Pastor ◽  
M.A. Perarnau

ChemPhysChem ◽  
2010 ◽  
Vol 11 (12) ◽  
pp. 2555-2560 ◽  
Author(s):  
Kannuchamy Vasanth Kumar ◽  
Mateus Carvalho Monteiro de Castro ◽  
Manuel Martinez-Escandell ◽  
Miguel Molina-Sabio ◽  
Francisco Rodriguez-Reinoso

2010 ◽  
Vol 492 (1-3) ◽  
pp. 187-192 ◽  
Author(s):  
K. Vasanth Kumar ◽  
M. Monteiro de Castro ◽  
M. Martinez-Escandell ◽  
M. Molina-Sabio ◽  
J. Silvestre-Albero ◽  
...  

2009 ◽  
Vol 94 (8) ◽  
pp. 083110 ◽  
Author(s):  
Nitesh Aggarwal ◽  
Ken Lawson ◽  
Matthew Kershaw ◽  
Robert Horvath ◽  
Jeremy Ramsden

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