相关论文: Microstructure from ferroelastic transitions using…

We study theoretically the influence of the underlying domain microstructure on the electromechanical properties of ferroelectrics. Our calculations are based on a continuum approach that incorporates the long-range elastic and…

The low frequency lattice vibrations and relaxations are investigated in single crystals of the four 3D hybrid organolead perovskites, MAPbBr$_3$, FAPbBr$_3$, MAPbI$_3$, and $\alpha$-FAPbI$_3$, at the Brillouin zone center using Raman and…

Many materials such as martensitic or ferromagnetic crystals are observed to be in metastable states exhibiting a fine-scale, structured spatial oscillation called microstructure; and hysteresis is observed as the temperature, boundary…

We derive underdamped evolution equations for the order-parameter (OP) strains of a ferroelastic material undergoing a structural transition, using Lagrangian variations with Rayleigh dissipation, and a free energy as a polynomial expansion…

By means of first-principles electronic structure calculations, we hereby investigate the structural transitions induced by epitaxial strain in (111)-oriented (LaMnO$_3$)$_{2n}|$(SrMnO$_3$)$_n$ superlattices, with $n=2,4,6$. All…

Atomistic deformation simulations in the nominally elastic regime are performed for a model binary glass with strain rates as low as $10^{4}$/sec (corresponding to 0.01 shear strain per 1$\mu$sec). A robust elasticity is revealed that…

This paper describes a two-dimensional (2D) finite element simulation for fracture and fatigue behaviours of pure alumina microstructures such as those found at hip prostheses. Finite element models are developed using actual Al2O3…

We formulate a phenomenological elasto-plastic theory to describe a solid undergoing a structural transition from a square (p4mm) to an oblique (p2) lattice in two dimensions. Within our theory, the components of the strain may be…

The domain size dependence of piezoelectric properties of ferroelectrics is investigated using a continuum Ginzburg-Landau model that incorporates the long-range elastic and electrostatic interactions. Microstructures with desired domain…

We present our theoretical and numerical results on thermodynamic properties and the microscopic mechanism of two successive transitions in vanadium spinel oxides $A$V$_2$O$_4$ ($A$=Zn, Mg, or Cd) obtained by Monte Carlo calculations of an…

Understanding the phase transformation pathways (PTPs) and microstructural evolution in multi-phase HEAs will aid alloy and process designs to tailor the microstructures for specific engineering applications. In this work, we study…

We investigate the nematic phase transition in the Heisenberg $J_1$-$J_2$-model on square and triangular lattices, accounting for finite lattice compressibility and bond-length-dependent magnetic exchange. Using Nematic Bond Theory, a…

The mean field type approach based on the self-consistent consideration of an effective field created by electron transfer is developed for a description of thermodynamics of the Hubbard type models with an infinitely large on-site…

The Langevin dynamics of a system exhibiting a Fluctuation Induced First Order Phase Transition is solved within the self consistent Hartree Approximation. Competition between interactions at short and long length scales gives rise to…

A single crystal of lead-zirconate-titanate (PZT), composition Pb(Zr0.80Ti0.20)O3, was studied by polarized-Raman scattering as a function of temperature. Raman spectra reveal that the local structure deviates from the average structure in…

We study, within the Ginzburg-Landau (GL) theory of phase transitions, how elastic deformations in a supersolid lead to local changes in the supersolid transition temperature. The GL theory is mapped onto a Schrodinger-type equation with an…

We study domain-wall excitations in two-dimensional random-bond Ising spin systems on a square lattice with side length L, subject to two different continuous disorder distributions. In both cases an adjustable parameter allows to tune the…

The effective quantum pseudospin-1/2 model for interacting rare-earth magnetic moments, which are locally described with atomic doublets, is studied theoretically for magnetic pyrochlore oxides. It is derived microscopically for localized…

We investigate in the framework of Landau theory the distortion of the strain fields at the interface of two dissimilar ferroelastic oxides that undergo a structural cubic-to-tetragonal phase transition. Simple analytical solutions are…

Twisted heterostructures of two-dimensional crystals offer almost unlimited scope for the design of novel metamaterials. Here we demonstrate a room-temperature ferroelectric semiconductor that is assembled using mono- or few- layer MoS2.…