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Ferroelastic phase transitions: structure and microstructure.

TLDR
In this article, the derivation of the Landau potential G = ½A θS [coth(θS/T) − coth(αS/TC)]Q2 + ¼BQ4 + … is derived as a solution of the general ϕ4 model.
Abstract
Landau-type theories describe the observed behaviour of phase transitions in ferroelastic and co-elastic minerals and materials with a high degree of accuracy. In this review, the derivation of the Landau potential G = ½AθS [coth(θS/T) − coth(θS/TC)]Q2 + ¼BQ4 + … is derived as a solution of the general ϕ4 model. The coupling between the order parameter and spontaneous strain of a phase transition brings the behaviour of many phase transitions to the mean-field limit, even when the atomistic mechanism of the transition is spin-like. Strain coupling is also a common mechanism for the coupling between multiple order parameters in a single system. As well as changes on the crystal structure scale, phase transitions modify the microstructure of materials, leading to anomalous mesoscopic features at domain boundaries. The mesostructure of a domain wall is studied experimentally using X-ray diffraction, and interpreted theoretically using Ginzburg–Landau theory. One important consequence of twin meso­structures is their modified transport properties relative to the bulk. Domain wall motion also provides a mechanism for superelastic behaviour in ferroelastics. At surfaces, the relaxations that occur can be described in terms of order parameters and Landau theory. This leads to an exponential profile of surface relaxations. This in turn leads to an exponential interaction energy between surfaces, which can, if large enough, destabilize symmetrical morphologies in favour of a platelet morphology. Surface relaxations may also affect the behaviour of twin walls as they intersect surfaces, since the surface relaxation may lead to an incompatibility of the two domains at the surface, generating large strains at the relaxation. Landau theory may also be extended to describe the kinetics of phase transitions. Time-dependent Landau theory may be used to describe the kinetics of order–disorder phase transitions in which the order parameter is homogeneous. However, the time-dependent Landau theory equations also have microstructural solutions, explaining the formation of microstructures such as tweed.

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Journal ArticleDOI

Direct observation of intrinsic twin domains in tetragonal CH 3 NH 3 PbI 3

TL;DR: Rothmann et al. as mentioned in this paper reported unambiguous evidence for crystallographic twin domains in tetragonal CH3NH3PbI3 perovskite, observed using low-dose transmission electron microscopy and selected area electron diffraction.
Journal ArticleDOI

Domain boundary engineering

TL;DR: The idea that domain boundaries, rather than domains, can carry information and act as memory devices is reviewed and it is agued that multiferroic walls can be described formally as chiral whereby the chirality relates to state-vectors such as polarisation and magnetic moment and their (non-linear) coupling.
Journal ArticleDOI

Phase stability and shear softening in CaSiO3 perovskite at high pressure

TL;DR: In this article, a simple scheme for systematically searching for the ground state over all perovskite structures derivable from octahedral rotations within the context of symmetry-preserving relaxation is presented.
Journal ArticleDOI

Intrinsic activation energy for twin-wall motion in the ferroelastic perovskite CaTiO 3

TL;DR: In this paper, the authors investigated the Peierls energy and the peierls stress in a one order parameter discrete Landau-Ginzburg model and a classical potential model of the ferroelastic perovskite.
Journal ArticleDOI

Origin of high piezoelectric response in A-site disordered morphotropic phase boundary composition of lead-free piezoelectric 0.93(Na0.5Bi0.5)TiO3–0.07BaTiO3

TL;DR: In this paper, a microscopic model derived from comparative analyses of high resolution transmission electron microscopy and neutron diffraction was proposed to explain the origin of high piezoelectric response in lead-free MPB compositions of 0.93(Na 0.5Bi0.5)TiO3
References
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Journal ArticleDOI

The SIESTA method for ab initio order-N materials simulation

TL;DR: In this paper, a selfconsistent density functional method using standard norm-conserving pseudopotentials and a flexible, numerical linear combination of atomic orbitals basis set, which includes multiple-zeta and polarization orbitals, was developed and implemented.
Journal ArticleDOI

Multiferroic BaTiO3-CoFe2O4 Nanostructures.

TL;DR: Thermodynamic analyses show that the magnetoelectric coupling in a nanostructured BaTiO3-CoFe2O4 ferroelectromagnet can be understood on the basis of the strong elastic interactions between the two phases.
Journal ArticleDOI

Electric polarization reversal and memory in a multiferroic material induced by magnetic fields.

TL;DR: A striking interplay between ferroelectricity and magnetism in the multiferroic TbMn2O5 is reported, demonstrated by a highly reproducible electric polarization reversal and permanent polarization imprint that are both actuated by an applied magnetic field.
Book

Physics at Surfaces

TL;DR: Physics at Surfaces as discussed by the authors is a unique graduate-level introduction to the physics and chemical physics of solid surfaces and atoms and molecules that interact with solid surfaces, and it provides a synthesis of the entire field of surface physics from the perspective of a modern condensed matter physicist with a healthy interest in chemical physics.
Journal ArticleDOI

Multi-ferroic magnetoelectrics

TL;DR: In this paper, the authors reviewed the domain aspects of multi-ferroics, i.e. of materials, in which two or all three properties of the properties "ferroelectricity" and "ferromagnetism" occur simultaneously in the same phase, and in which the magnetic point group has been reliably established by magnetoelectric, optical, dielectric and related studies on single crystals and single domains.
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