Monte Carlo simulations of orientational ordering of solutes in a nematic solvent: comparison with mean-field models

1996 ◽  
Vol 88 (3) ◽  
pp. 767-782 ◽  
Author(s):  
JAMES POLSON ◽  
E.ELLIOTT BURNELL
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Mean Field ◽  
Mean Field Models ◽  
Orientational Ordering ◽  
Nematic Solvent

Ion binding to polyelectrolytes: Monte Carlo simulations versus classical mean field theories

2009 ◽  
Vol 123 (1-2) ◽  
pp. 127-135 ◽  
Author(s):  
Sergio Madurga ◽  
Josep Lluís Garcés ◽  
Encarnació Companys ◽  
Carlos Rey-Castro ◽  
José Salvador ◽  
...  
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Mean Field ◽  
Field Theories ◽  
Ion Binding ◽  
Mean Field Theories

Demixing and ordering in Ni(Ti,Zr)(Sb,Sn) half-Heusler materials

2017 ◽  
Vol 19 (45) ◽  
pp. 30695-30702 ◽  
Author(s):  
Joaquin Miranda Mena ◽  
Thomas Gruhn
Keyword(s):  
Density Functional Theory ◽  
Monte Carlo ◽  
Phase Separation ◽  
Monte Carlo Simulations ◽  
Density Functional ◽  
Field Model ◽  
Mean Field ◽  
Study Phase ◽  
Mean Field Model ◽  
Functional Theory

We employed density functional theory, Monte Carlo simulations and a mean field model to study phase separation in thermoelectric Ni(Ti,Zr)(Sb,Sn) half-Heusler materials, simultaneously alloyed in the (Ti,Zr)- and (Sb,Sn) sublattices.

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