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A continuum grain boundary model is developed that uses experimentally measured grain boundary energy data as a function of misorientation to simulate idealized grain boundary evolution in a 1-D grain array. The model uses a continuum…

Materials Science · Physics 2024-01-29 Syed Ansari , Amit Acharya , Alankar Alankar

We present a general class of geometric network growth mechanisms by homogeneous attachment in which the links created at a given time $t$ are distributed homogeneously between a new node and the exising nodes selected uniformly. This is…

Physics and Society · Physics 2018-03-28 Charles Murphy , Antoine Allard , Edward Laurence , Guillaume St-Onge , Louis J. Dubé

This paper investigates the statistical behavior of two-dimensional grain microstructures during grain growth under anisotropic grain boundary characters. We employ the threshold-dynamics method, which allows for unparalleled computational…

Materials Science · Physics 2023-09-19 Jaekwang Kim , Nikhil Chandra Admal

A general formulation of stochastic thermodynamics is presented for open systems exchanging energy and particles with multiple reservoirs. By introducing a partition in terms of "macrostates" (e.g. sets of "microstates"), the consequence on…

Statistical Mechanics · Physics 2015-06-03 Massimiliano Esposito

For one-dimensional growth processes we consider the distribution of the height above a given point of the substrate and study its scale invariance in the limit of large times. We argue that for self-similar growth from a single seed the…

Statistical Mechanics · Physics 2009-10-31 Michael Praehofer , Herbert Spohn

We present a method to include the evolution of the grain size and grain opacity $\kappa_\mathrm{gr}$ in the equations describing the structure of protoplanetary atmospheres. The key assumption of this method is that a single grain size…

Earth and Planetary Astrophysics · Physics 2015-06-22 Chris W. Ormel

In this paper three different approaches towards a continuum theory of fiber suspensions are discussed. The first one is the classical Thermodynamics of Irreversible Processes with internal variables. It derives constitutive equations for…

Materials Science · Physics 2007-05-23 C. Papenfuss , J. Verhas , W. Muschik

The problem of the insensitivity of the macroscopic behavior of any thermodynamical system to partitioning generates a bias between the reproducibility of its macroscopic behavior viewed as the simplest form of causality and its long-term…

General Physics · Physics 2007-05-23 Maria K. Koleva

Understanding and controlling the properties and dynamics of topological defects is a lasting challenge in the study of two-dimensional materials, and is crucial to achieve high-quality films required for technological applications. Here…

Materials Science · Physics 2017-06-28 Doaa Taha , S. K. Mkhonta , K. R. Elder , Zhi-Feng Huang

The evolution of grain structures in materials is a complex and multiscale process that determines the material's final properties. Understanding the dynamics of grain growth is a key factor for controlling this process. We propose a…

Materials Science · Physics 2012-04-12 D. T. Hristopulos , L. Leonidakis , A. Tsetsekou

A model for gas bubble behavior in irradiated amorphous $U_3Si_2$ is generalized to take into account local influence of sinks for point defects and gas atoms as far as defect clustering resulting in growth of dislocation loops. A…

Statistical Mechanics · Physics 2021-12-30 V. O. Kharchenko , D. O. Kharchenko , O. M. Shchokotova , V. V. Kupriienko , Lu Wu

Grain boundaries often exhibit ordered atomic structures. Increasing amounts of evidence have been provided by transmission electron microscopy and atomistic computer simulations that different stable and metastable grain boundary…

Materials Science · Physics 2023-02-14 Tobias Brink , Lena Langenohl , Hanna Bishara , Gerhard Dehm

Dynamic recrystallization is one of the main phenomena responsible for microstructure evolutions during hot forming. Consequently, getting a better understanding of DRX mechanisms and being able to predict them is crucial. This paper…

Computational Engineering, Finance, and Science · Computer Science 2022-12-14 Victor Grand , Baptiste Flipon , Alexis Gaillac , Marc Bernacki

Two finite element level-set (FE-LS) formulations are compared for the modeling of grain growth of 316L stainless steel in terms of grain size, mean values and histograms. Two kinds of microstructures are considered, some are generated…

Materials Science · Physics 2022-04-06 Brayan Murgas , Baptiste Flipon , Nathalie Bozzolo , Marc Bernacki

To study materials phenomena simultaneously at various length scales, descriptions in which matter can be coarse grained to arbitrary levels, are necessary. Attempts to do this in the static regime (i.e. zero temperature) have already been…

Materials Science · Physics 2009-11-07 Stefano Curtarolo , Gerbrand Ceder

We consider quasistatic fiber bundle models with interactions. Classical load sharing rules are considered, i.e. local, global or decaying as a power-law of distance. All fibers are identically elastic, initially intact, and break at a…

Materials Science · Physics 2007-05-23 Renaud Toussaint

Recent grain growth experiments have revealed that the same type of grain boundary can have very different mobilities depending on its local microstructure. In this work, we use molecular dynamics simulations to quantify uncertainty in the…

Materials Science · Physics 2022-11-17 Anqi Qiu , Ian Chesser , Elizabeth Holm

Topological indices play a significant role in mathematical chemistry. Given a graph $\mathcal{G}$ with vertex set $\mathcal{V}=\{1,2,\dots,n\}$ and edge set $\mathcal{E}$, let $d_i$ be the degree of node $i$. The degree-based topological…

Combinatorics · Mathematics 2023-10-09 Mingao Yuan

We explore the effects of surface tension and mobility models in simulations of grain growth using threshold dynamics algorithms that allow performing large scale simulations, while naturally capturing the Herring angle condition at…

Materials Science · Physics 2019-07-29 Tiago Salvador , Selim Esedoglu

We present a statistical mechanical description of randomly packed spherical particles, where the average coordination number is treated as a macroscopic thermodynamic variable. The overall packing entropy is shown to have two…

Soft Condensed Matter · Physics 2022-02-02 Jack A. Logan , Alexei V. Tkachenko