A microscopic derivation of macroscopic sharp interface problems involving phase transitions

Macroscopic free boundary problems involving phase transitions (e.g., the classical Stefan problem or its modifications) are derived in a unified way from a Hamiltonian based on a general set of microscopic interactions. A Hamiltonian of the form + _x,x J(x–x)(x)(x) leads to differential equations as a result of Fourier transforms. Expanding the Fourier transform ofJ in powers ofq (the wave number), one can truncate the series at anarbitrary orderM, and thereby obtainMth-order differential equations. An asymptotic analysis of these equations in various scalings of the physical parameters then implies limits which are the standard macroscopic models for the dynamics of phase boundaries.     

Orbital magnetism and the structural phase transitions in crystals with Jahn-Teller ions

The possibility of orbital magnetism and structural phase transitions in crystals with “orbital exchange” and vibronically coupled Jahn-Teller ions are examined.     

Birefringence and phase transitions in liquid crystals

The birefringence of liquid-crystalline phases is the result of the parallel order of molecules exhibiting a polarizability anisotropy. The magnitude and sign of the birefringence are determined by the structure and order of the liquid-crystalline phase types as well as by the polarizability properties of the constituent molecules. The characteristic change of the birefringence at phase transitions between liquid-crystalline phases indicates more or less pronounced structural changes. The temperature dependence of the birefringence is due to the temperature change of the molecular order.

It is shown that the structural variety of the liquid crystalline state is reflected by a big variety of their optical anisotropy properties.     

Ordering and phase transitions in liquid crystals

Structures and properties of different types of liquid crystals are discussed from a uniform point of view. Apart from the traditional mesophases (nematics, cholesterics, smectics), some new examples, including polymeric, metalloorganic and ferromagnetic liquid crystals, are also investigated. Systems with several macroscopic scales on which the type of ordering may differ, are described and analysed. Phase transitions and certain types of critical behaviour in different liquid crystals are studied.     

Reentrant phase transitions in liquid crystals

A comprehensive review of the recent developments regarding the phenomenon of reentrant phase transitions (RPT) in liquid crystals is presented. In addition to liquid crystals this phenomenon has been observed in amazingly diverse systems. A critical assessment of the experimental investigations concerning single and multiple reentrances is given. A brief account of the theoretical efforts is also given. The article ends with the identification of the factors which impede the proper understanding of the phenomenon.     

Multipolar phase transitions in magnetic crystals

We have studied the possibility of successive multipolar phase transitions in magnetic crystals. A Hamiltonian including various (l ? 4) multipolar interactions is treated in the molecularfield approximation. If each interaction is introduced with its characteristic symmetry, three successive phase transitions at most are found in the absence of any crystalline field anisotropy.     

Quantum capacitance: A microscopic derivation

We start from microscopic approach to many body physics and show the analytical steps and approximations required to arrive at the concept of quantum capacitance. These approximations are valid only in the semi-classical limit and the quantum capacitance in that case is determined by Lindhard function. The effective capacitance is the geometrical capacitance and the quantum capacitance in series, and this too is established starting from a microscopic theory.     

Field-induced phase transitions in antiferroelectric liquid crystals

A theoretical study is made of the process by which an antiferroelectric smectic liquid crystal undergoes a field-induced transition to ferroelectric alignment. We find that for cells of moderate thickness the initial departure from antiferroelectric alignment occurs as a continuous Fréedericksz transition. The following transition from partial alignment to complete ferroelectric ordering may occur as either a first-order or continuous transition, depending on the relative strength of some of the model parameters. The case where the transition is continuous provides a possible mechanism for some recently observed thresholdless transitions in these systems.     

Hierarchical microstructure in structural phase transitions

We consider a model in the context of martensitic materials in which hierarchical twinning near the habit plane (austenite-martensite interface) is a new and crucial ingredient. The model includes (1) a triple-well potential in local deviatoric (rectangular) strain, (2) strain gradient terms up to second order in strain and fourth order in gradient, and (3) all symmetry allowed compositional fluctuation-induced strain gradient terms. The last term favors branching of domain walls which enables communication between macroscopic and microscopic regions essential for shape memory. Below the transition temperature (T₀) we obtain the conditions under which branching of twins is energetically favorable. Above T₀ a hierarchy of branched domain walls also stabilizes tweed formation (criss-cross patterns of twins). External stress or pressure modulates (“patterns”) the spacing of domain walls. Results based on 2D time-dependent Ginzburg-Landau simulations are shown for twins, tweed and hierarchy formation.     

Anharmonic phonons and structural phase transitions

Exact results for the order parameter and the meansquare displacement as functions of temperature are given for a quantum interacting phonon Hamiltonian with quartic anharmonicities. Upper bounds for the transition temperature are also derived. Approximate theories including the mean field approximation, the random phase approximation (or quasiharmonic approximation) and the self consistent approach (using Blume-Hubbard scheme) are compared with our exact results. The mean field approximation for the meansquare displacement is found to violate our bounds.The classical value is shown to form a lower bound for the kinetic energy. Upper bounds for the kinetic energy are obtained showing the region of temperature in which the use of the high temperature expansion of the fluctuation-dissipation theorem is justified. Comparison of the Hamiltonian and our results with electron-paramagnetic-resonance measurements are discussed.     

Lattice dynamics and structural phase transitions

Results of lattice dynamics, or atomic motions in a solid, explain many of the thermodynamic properties of solids. Inelastic neutron scattering conveniently explores the atomic motions, quantized as phonons. Of particular interest are materials that undergo structural phase transitions. The soft mode theory has been successful in relating anomalous phonon behavior to structural changes in solids. One such example is the ferromagnetic shape memory alloy, Ni₂MnGa, which undergoes a sequence of phase transitions leading to a magnetic, incommensurate modulated, tetragonal phase as the ground state. The experiments, coupled with first principles calculations, provide evidence that strong electron–phonon coupling is the driving mechanism of the phase transformation.     

Acoustic studies of phase transitions in crystals and nanocomposites

A brief review of acoustic studies of phase transitions in crystals (ferroelectric, ferroelastic, and superionic ones) and nanostructured composite materials made on the basis of porous matrices is presented. The studies were carried out at the Laboratory of Quantum Acoustics and Ultrasonic Spectroscopy of the St. Petersburg State University.     

Crystal imperfections and structural phase transitions in perovskites

High‐resolution X-ray scattering measurements of the antiferrodistortive phase transitions in the perovskites SrTiO₃, RbCaF₃ and KMnF₃ have recently revealed the existence of two length scales in the critical scattering above T_e . Here we review these observations and discuss how they might be related to the well known existence of two time scales (the "central peak" problem) in the critical dynamic response function above T_e . We reach the tentative conclusion that within a few degrees of T_e both the time and length scales of the fluctuations are strongly influenced by defects and that the intrinsic critical behaviour is swamped by these effects in most crystals.