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Related papers: Atomistic modelling of the Shape Memory Effect

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The shape memory behavior of a NiTi nanoparticle is analyzed by molecular dynamics simulations. After a detailed description of the equilibrium structures of the used model potential, the multi variant martensitic ground state, which…

Materials Science · Physics 2022-01-04 Daniel Mutter , Peter Nielaba

In this paper, the finite volume method is developed to analyze coupled dynamic problems of nonlinear thermoelasticity. The major focus is given to the description of martensitic phase transformations essential in the modelling of shape…

Computational Engineering, Finance, and Science · Computer Science 2025-10-20 Linxiang X. Wang , Roderick V. N. Melnik

The work presents a thermomechanical model for polycrystalline NiTi-based shape memory alloys developed within the framework of generalized standard solids, which is able to cover loading-mode dependent localization of the martensitic…

Materials Science · Physics 2025-04-24 M. Frost , B. Benešová , H. Seiner , M. Kružík , P. Šittner , P. Sedlák

Equiatomic nickle-titanium (NiTi) is investigated to determine the consequences of point defects on the Martensitic phase transformation. Using molecular dynamics (MD) simulations, NiTi with 0.1%, 0.5%, 1%, 2%, and 3% of Schottky-type…

Materials Science · Physics 2015-05-01 Aria Mansouri Tehrani , Hamidreza Shahrokhshahi , Nader Parvin , Jakoah Brgoch

This paper presents a comparative study between two micro-macro modeling approaches to simulate stress-induced martensitic transformation in shape memory alloys (SMA). One model is a crystal plasticity based model and the other describes…

Classical Physics · Physics 2019-06-20 Mame Fall , Etienne Patoor , Olivier Hubert , K Lavernhe -Taillard

By means of molecular-dynamics simulations, temperature driven diffusionless structural phase transitions in equi- and nearly equiatomic ordered nickel-titanium alloys were investigated. For this purpose, a model potential from the…

Materials Science · Physics 2022-01-04 Daniel Mutter , Peter Nielaba

Employing the Ginzburg-Landau phase-field theory, a new coupled dynamic thermo-mechanical 3D model has been proposed for modeling the cubic-to-tetragonal martensitic transformations in shape memory alloy (SMA) nanostructures. The…

Materials Science · Physics 2015-05-20 R. Dhote , H. Gomez , R. Melnik , J. Zu

The identification and use of reversible Martensitic transformations, typically described as shape memory transformations, as a new class of solid-solid phase change material is experimentally demonstrated here for the first time. To prove…

Materials Science · Physics 2019-05-01 Darin J. Sharar , Brian F. Donovan , Ronald J. Warzoha , Adam A. Wilson , Asher C. Leff

Molecular dynamics simulations are performed to provide a detailed understanding of the functional degradation of shape memory alloys at small scale. The origin of the experimentally reported accumulation of plastic deformation and the…

Materials Science · Physics 2021-04-02 Won-Seok Ko , Won Seok Choi , Guanglong Xu , Pyuck-Pa Cho , Yuji Ikeda , Blazej Grabowski

We use phase field simulations to study composites made of two different ferroelastics (e.g., two types of martensite). The deformation of one material due to a phase transformation can elastically affect the other constituent and induce it…

Materials Science · Physics 2009-03-25 Mathieu Bouville , Rajeev Ahluwalia

The dynamics of phase transitions plays a crucial r\^ole in the so-called interface between high energy particle physics and cosmology. Many of the interesting results generated during the last fifteen years or so rely on simplified…

High Energy Physics - Phenomenology · Physics 2007-05-23 Marcelo Gleiser

In this work, a theoretical study of phase equilibrium in mixtures of a calamitic nematic liquid crystal and hard spherical nanoparticles is presented. A mean-field thermodynamic model is used, where the interactions are considered to be…

Materials Science · Physics 2013-11-22 Ezequiel R. Soulé , Linda Reven , Alejandro D. Rey

The reverse martensitic ("austenitic") transformation upon heating of equiatomic nickel-titanium nanoparticles with diameters between 4 and 17 nm is analyzed by means of molecular-dynamics simulations with a semi-empirical model potential.…

Materials Science · Physics 2022-01-04 Daniel Mutter , Peter Nielaba

The dynamics of phase transitions plays a crucial r\^ole in the so-called interface between high energy particle physics and cosmology. Many of the interesting results generated during the last fifteen years or so rely on simplified…

High Energy Physics - Phenomenology · Physics 2007-05-23 Marcelo Gleiser

A general procedure for studying finite-N effects in quantum phase transitions of finite systems is presented and applied to the critical-point dynamics of nuclei undergoing a shape-phase transition of second-order (continuous), and of…

Nuclear Theory · Physics 2007-05-23 A. Leviatan

Nanoporous metals or nanofoams are a promising material class that is considered for sensing, actuation, and catalysis. To date, they mostly based on simple noble metals such as nanoporous gold, which exhibit peculiar stress-strain response…

Materials Science · Physics 2022-07-29 Arne J. Klomp , Karsten Albe

The connection between the thermodynamics of charged finite nuclear systems and the asymptotically measured partitions is presented. Some open questions, concerning in particular equilibrium partitions are discussed. We show a detailed…

Using a modified Lennard-Jones model for anisotropic particles, we present results of molecular dynamics simulation in two dimensions. In one-component systems, we find crystallization, a Berezinskii-Kosterlitz-Thouless phase, and a…

Soft Condensed Matter · Physics 2011-12-23 Kyohei Takae , Akira Onuki

Lattice dynamical methods used to predict phase-transformations in crystals typically evaluate the harmonic phonon spectra and therefore do not work in frequent and important situations where the crystal structure is unstable in the…

Materials Science · Physics 2015-05-18 Petros Souvatzis , Dominik Legut , Olle Eriksson , Mikhail I. Katsnelson

The thermodynamic properties of nuclei are studied in a mean field model using a Skryme interaction. Properties of two component systems are investigated over the complete range of proton fraction from a system of pure neutrons to a system…

Nuclear Theory · Physics 2008-11-26 S. J. Lee , A. Z. Mekjian
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