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Related papers: Phase-field study of grain boundary tracking behav…

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The phase diagram of the spin-1 Ising model in the presence of a biaxial crystal-field anisotropy is studied within the framework of a variational approach, based on the Bogolyubov inequality for the free energy. We have investigated the…

Statistical Mechanics · Physics 2008-03-07 J. Ricardo de Sousa , N. S. Branco

We introduce a Phase Field Crystal (PFC) model for particles with n-fold rotational symmetry in two dimensions. Our approach is based on a free energy functional that depends on the reduced one-particle density, the strength of the…

Soft Condensed Matter · Physics 2023-02-02 Robert F. B. Weigel , Michael Schmiedeberg

I consider a generic coarse-grained model suitable for the study of bulk self-assembly of liquid crystal (LC) macromolecules. The cases include LC dendrimers, gold nanoparticles modified by polymer chains with terminating LC groups and…

Soft Condensed Matter · Physics 2013-12-17 J. M. Ilnytskyi

This study proposes a new analytical model for grain boundary pinning by second phase particles in two-dimensional polycrystals. This approach not only considers how particles impede grain growth, but also elucidates their role in…

Materials Science · Physics 2024-04-23 Madeleine Bignon , Marc Bernacki

The stacking sequence of hexagonal close-packed and related crystals typically results in steps on vicinal {0001} surfaces that have alternating A and B structures with different growth kinetics. However, because it is difficult to…

Resistivity measurements are widely exploited to uncover electronic excitations and phase transitions in metallic solids. While single crystals are preferably studied to explore crystalline anisotropies, these usually cancel out in…

The effect of stress-triaxiality on growth of a void in a three dimensional single-crystal face-centered-cubic (FCC) lattice has been studied. Molecular dynamics (MD) simulations using an embedded-atom (EAM) potential for copper have been…

Materials Science · Physics 2009-11-10 E. T. Seppälä , J. Belak , R. E. Rudd

Crack growth behaviour along the coherent twin boundary (CTB), i.e., $\Sigma$3{112} of BCC Fe is investigated using molecular dynamics (MD) simulations. The growth of an atomistically sharp crack with {112}$<$110$>$ orientation has been…

Materials Science · Physics 2016-11-09 G. Sainath , B. K. Choudhary

The growth of crystals confined in porous or cellular materials is ubiquitous in Nature and industry. Confinement affects the formation of biominerals in living organisms, of minerals in the Earth's crust and of salt crystals damaging…

Materials Science · Physics 2022-11-30 Felix Kohler , Olivier Pierre-Louis , Dag Kristian Dysthe

High-energy synchrotron x-rays are used to track grain rotations and the micromechanical evolution of a hexagonal Ti-7Al microstructure as it is cyclically loaded below its macroscopic yield stress. The evolution of the grains through 200…

Materials Science · Physics 2020-10-02 Rachel E. Lim , Joel V. Bernier , Darren C. Pagan , Paul A. Shade , Anthony D. Rollett

Grain growth in polycrystals is one of the principal mechanisms that take place during heat treatment of metallic components. This work treats an aspect of the anisotropic grain growth problem. By applying the first principles of…

Computational Engineering, Finance, and Science · Computer Science 2020-06-30 J. Fausty , B. Murgas , S. Florez , N. Bozzolo , M. Bernacki

We use numerical simulations and linear stability analysis to study the dynamics of an active liquid crystal film on a substrate in the regime where the passive system would be isotropic. Extensile activity builds up local orientational…

Soft Condensed Matter · Physics 2023-09-26 Fernando Caballero , Zhihong You , M. Cristina Marchetti

Voids develop in crystalline materials under energetic particle irradiation, as in nuclear reactors. Understanding the underlying mechanisms of void nucleation and growth is of utmost importance as it leads to dimensional instability of the…

Materials Science · Physics 2024-05-24 Sreekar Rayaprolu , Kyle Starkey , Anter El-Azab

This study addresses microstructure selection mechanisms in rapid solidification, specifically targeting the transition from cellular/dendritic to planar interface morphologies under conditions relevant to additive manufacturing. We use a…

We investigate the dynamics of cellular solidification patterns using three-dimensional phase-field simulations. The cells can organize into stable hexagonal patterns or exhibit unsteady evolutions. We identify the relevant secondary…

Materials Science · Physics 2009-11-07 Mathis Plapp , Marcus Dejmek

Within self-consistent field theory we study the phase behavior of a symmetrical binary AB polymer blend confined into a thin film. The film surfaces interact with the monomers via short range potentials. One surface attracts the A…

Statistical Mechanics · Physics 2007-05-23 M. Mueller , K. Binder , E. V. Albano

We study the step bunching kinetic instability in a growing crystal surface characterized by anisotropic diffusion. The instability is due to the interplay between the elastic interactions and the alternation of step parameters. This…

Statistical Mechanics · Physics 2009-11-11 T. Frisch , A. Verga

Grain growth competition during solidification determines microstructural features, such as dendritic arm spacings, segregation pattern, and grain texture, which have a key impact on the final mechanical properties. During metal additive…

Materials Science · Physics 2023-06-23 Rouhollah Tavakoli , Damien Tourret

Crystallization of supersaturated liquids usually starts by heterogeneous nucleation. Mounting evidence shows that even homogeneous nucleation in simple liquids takes place in two steps; first a dense amorphous precursor forms, and the…

Materials Science · Physics 2014-07-15 László Gránásy , Frigyes Podmaniczky , Gyula I. Tóth , György Tegze , Tamás Pusztai

We discuss steady state crack growth in the spirit of a free boundary problem. It turns out that mode I and mode III situations are very different from each other: In particular, mode III exhibits a pronounced transition towards unstable…

Materials Science · Physics 2009-11-13 R. Spatschek , E. A. Brener , D. Pilipenko