Phase diagram for the lattice model of amphiphile and solvent mixtures by Monte Carlo simulation

1992 ◽  
Vol 88 (15) ◽  
pp. 2163 ◽  
Author(s):  
David Brindle ◽  
Christopher M. Care
Keyword(s):  
Phase Diagram ◽  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Lattice Model ◽  
Solvent Mixtures

scholarly journals LATTICE MODEL OF ADSORPTION OF MULTISITE TRIANGLES WITH ATTRACTIVE VERTEXES: PARAMETRIZATION FOR 1, 3, 5-TRIS(PYRIDYL)BENZENE AND CU ON OXIDATED TITANIUM CARBIDE SURFACE

2020 ◽  
Vol 7 (4) ◽  
pp. 004-011
Author(s):  
O. S. Solovyeva ◽  
◽  
V. A. Gorbunov ◽  
A. V. Myshlyavtsev ◽  
◽  
...  
Keyword(s):  
Phase Diagram ◽  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Ground State ◽  
Lattice Model ◽  
Adsorption Layer ◽  
Ground State Phase Diagram ◽  
Component System ◽  
Simple Lattice ◽  
Metal Organic

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.

Monte Carlo simulation of a lattice model for micelle formation

1994 ◽  
Vol 101 (1) ◽  
pp. 645-650 ◽  
Author(s):  
Américo T. Bernardes ◽  
Vera B. Henriques ◽  
Paulo M. Bisch
Keyword(s):  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Lattice Model ◽  
Micelle Formation

PHASE DIAGRAM OF DOUBLE EXCHANGE MODEL WITH ANTIFERROMAGNETIC COUPLING FOR LOCALIZED t2g SPINS IN ONE DIMENSION REVISITED

2005 ◽  
Vol 19 (24) ◽  
pp. 3731-3743 ◽  
Author(s):  
Q. L. ZHANG
Keyword(s):  
Phase Diagram ◽  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Large Scale ◽  
Double Exchange ◽  
Exchange Model ◽  
One Dimension ◽  
Antiferromagnetic Coupling ◽  
Single Orbit ◽  
Superexchange Coupling

The phase diagram of the single-orbit double exchange model for manganites with ferromagnetic Hund coupling between mobile eg electrons and spins of localized t2g electrons as well as antiferromagnetic superexchange coupling between t2g electrons is investigated with a large scale Monte Carlo simulation in one dimension. The phase boundary is determined based on the internal energy, the electron density and the structure factor. In particular, low-temperature properties at quarter filling are studied in detail.

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