Monte Carlo Simulation of Cu−Ni Nanoclusters: Surface Segregation Studies

Langmuir ◽  
2001 ◽  
Vol 17 (6) ◽  
pp. 2047-2050 ◽  
Author(s):  
Daniela S. Mainardi ◽  
Perla B. Balbuena
Keyword(s):  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Surface Segregation

MONTE CARLO SIMULATION OF THE SURFACE SEGREGATION OF Au75Pd25 AT (110) SURFACE USING AN ANALYTIC EMBEDDED ATOM METHOD

2007 ◽  
Vol 14 (03) ◽  
pp. 411-417 ◽  
Author(s):  
YU CHEN ◽  
SHUZHI LIAO
Keyword(s):  
Experimental Data ◽  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Surface Segregation ◽  
Embedded Atom Method ◽  
Depth Profiles ◽  
The Third ◽  
Embedded Atom ◽  
Reconstructed Surface ◽  
Concentration Depth Profiles

The surface concentrations and concentration depth profiles to the (110) surface of an Au 75 Pd 25 alloy is studied by modified analytical embedded atom method (MAEAM) with the Monte Carlo simulations. The results indicate that Au enriched in the two topmost layers, but depleted in the third layer. The Au concentration in the non-reconstructed surface is less than that in the reconstructed surface. Au concentration in third layer of reconstructed surface, which is more agreement with experimental data in present simulations, is about 63% 61% and 55%, at 800K, 600K and 400K respectively. Thus the present simulations are helpful for a better understanding of surface segregation of AuPd alloys.

Monte Carlo simulation of the surface segregation of Pt–Pd and Pt–Ir alloys with an analytic embedded-atom method

2002 ◽  
Vol 517 (1-3) ◽  
pp. 177-185 ◽  
Author(s):  
Huiqiu Deng ◽  
Wangyu Hu ◽  
Xiaolin Shu ◽  
Lihua Zhao ◽  
Bangwei Zhang
Keyword(s):  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Surface Segregation ◽  
Embedded Atom Method ◽  
Embedded Atom

scholarly journals Surface segregation in polymer blends: a Monte Carlo simulation

1992 ◽  
Vol 25 (19) ◽  
pp. 4895-4901 ◽  
Author(s):  
P. Cifra ◽  
F. E. Karasz ◽  
W. J. MacKnight
Keyword(s):  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Polymer Blends ◽  
Surface Segregation
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