E1512

MONTE CARLO STUDY OF THE BEHAVIOUR OF THE LANDAU FREE ENERGY AND ORDER PARAMETER IN THE 3D-(4 MODEL. S. Radescu*, I. Etxebarria** and J.M. Perez-Mato**, *Departamento de Fisica Fundamental y Experimental, Universidad de La Laguna, La Laguna E-38205, Tenerife, Spain, **Departamento de Fisica de la Materia Condensada,Facultad de Ciencias, Universidad del Pais Vasco,Apdo 644, E-48080 Bilbao, Spain

We have investigated the features of the structural second order phase transitions modelled by a simple three dimensional (4 model within the framework of the phenomenological Landau theory. At each fixed temperature we have computed the ditribution of the order parameter via the Monte Carlo method using a Metropolis statistical sample scheme with a 10x10x10 grid, and from this histogram distribution we have obtained the value of the primary order parameter, <Q>, as a function of temperature.We have studied the behaviour of the Landau coefficients and of the order parameter as a function of the temperature, and have obtained the critical temperature for the transition. We have also compared the results of our study with the analytical results for the cases of high and low temperature (displacive and order-disorder limits, respectively). Considering different model parameters ranging from the typical displacive analitical limit to a nearly pure order-disorder limit and taking into account the results of a simulation for the 3D Ising model at zero magnetic field we observe a simple law which can be related to the displacive degree of the system. In particular, we find the important result that for a large interval of temperatures "outside" any possibly critical region a simple non-classical (Tc-T)( power law accurately models the temperature dependence of the order parameter. The value of the exponent ( has been proposed to be related to the displacive/order-disorder degree of the system.

References:

G.Ciccotti, D.Frenkel and I.R.MacDonald Simulation of liquids and solids: Molecular Dynamics and Monte Carlo methods in statistical mechanics (North Holland, Amsterdam, 1990)

A.D.Bruce Monte Carlo Methods in Statistical Physics (Springer, 1979)