The Phase Diagram of an Anisotropic Potts Model

A study is made of an anisotropic Potts model in three dimensions where the coupling depends on both the Potts state on each site but also the direction of the bond between them using both analytical and numerical methods. The phase diagram is mapped out for all values of the exchange interactions. Six distinct phases are identified. Monte Carlo simulations have been used to obtain the order parameter and the values for the energy and entropy in the ground state and also the transition temperatures. Excellent agreement is found between the simulated and analytic results. We find one region where there are two phase transitions with the lines meeting in a triple point. The orbital ordering that occurs in $LaMnO_3$ occurs as one of the ordered phases.Comment: 30 pages, 19 figures, one tabl

Tunneling and the Spectrum of the Potts Model

The three-dimensional, three-state Potts model is studied as a paradigm for high temperature quantum chromodynamics. In a high statistics numerical simulation using a Swendson-Wang algorithm, we study cubic lattices of dimension as large as $64^3$ and measure correlation functions on long lattices of dimension $20^2\times 120$ and $30^2\times 120$. These correlations are controlled by the spectrum of the transfer matrix. This spectrum is studied in the vicinity of the phase transition. The analysis classifies the spectral levels according to an underlying $S_3$ symmetry. Near the phase transition the spectrum agrees nicely with a simple four-component hamiltonian model. In the context of this model, we find that low temperature ordered-ordered interfaces nearly always involve a disordered phase intermediate. We present a new spectral method for determining the surface tension between phases.Comment: 26 pages plus 13 Postscript figures (Axis versions also provided), UU-HEP-92/

Thermodynamic characteristics of the classical n-vector magnetic model in three dimensions

The method of calculating the free energy and thermodynamic characteristics of the classical n-vector three-dimensional (3D) magnetic model at the microscopic level without any adjustable parameters is proposed. Mathematical description is perfomed using the collective variables (CV) method in the framework of the $\rho^4$ model approximation. The exponentially decreasing function of the distance between the particles situated at the N sites of a simple cubic lattice is used as the interaction potential. Explicit and rigorous analytical expressions for entropy,internal energy, specific heat near the phase transition point as functions of the temperature are obtained. The dependence of the amplitudes of the thermodynamic characteristics of the system for $T>T_c$ and $T<T_c$ on the microscopic parameters of the interaction potential are studied for the cases $n=1,2,3$ and $n\to\infty$. The obtained results provide the basis for accurate analysis of the critical behaviour in three dimensions including the nonuniversal characteristics of the system.Comment: 25 pages, 5 figure

Screening Constitutional Isomers of C3H2O2 for Thermodynamic Properties Obtained from Systematic Electron Structure Calculations

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