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Despite the fundamental importance of solid-solid transformations in many technologies, the microscopic mechanisms remain poorly understood. Here, we explore the atomistic mechanisms at the migrating interface during solid-solid phase…

材料科学 · 物理学 2023-10-31 Yanyan Liang , Grisell Díaz Leines , Ralf Drautz , Jutta Rogal

Genetic algorithms are high-level heuristic optimization methods which enjoy great popularity thanks to their intuitive description, flexibility, and, of course, effectiveness. The optimization procedure is based on the evolution of…

概率论 · 数学 2026-03-27 Giacomo Borghi

This paper presents a trajectory generation method that optimizes a quadratic cost functional with respect to linear system dynamics and to linear input and state constraints. The method is based on continuous-time flatness-based trajectory…

系统与控制 · 计算机科学 2012-11-27 Jean-Francois Stumper , Ralph Kennel

Branching can be observed at the austenite-martensite interface of martensitic phase transformations. For a model problem, Kohn and M\"uller studied a branching pattern with optimal scaling of the energy with respect to its parameters.…

数值分析 · 数学 2016-01-07 Patrick Dondl , Behrend Heeren , Martin Rumpf

We propose a method for crystal structure prediction based on a new structure generation algorithm and on-lattice machine learning interatomic potentials. Our algorithm generates the atomic configurations assigning atomic species to sites…

材料科学 · 物理学 2023-06-08 Vadim Sotskov , Alexander V. Shapeev , Evgeny V. Podryabinkin

A mathematical framework is proposed to predict the features of the (5 5 7) lath transformation in low-carbon steels based on energy minimisation. This theory generates a one-parameter family of possible habit planes and a selection…

材料科学 · 物理学 2016-05-02 Anton Muehlemann , Konstantinos Koumatos

We introduce a stochastic algorithm that acts as a prime number generator. The dynamics of such algorithm gives rise to a continuous phase transition which separates a phase where the algorithm is able to reduce a whole set of integers into…

计算物理 · 物理学 2009-11-13 Bartolo Luque , Lucas Lacasa , Octavio Miramontes

Topological order characterizes those phases of matter that defy a description in terms of symmetry and cannot be distinguished in terms local order parameters. This type of order plays a key role in the theory of the fractional quantum…

量子物理 · 物理学 2009-11-13 Alioscia Hamma , Daniel A. Lidar

Global optimization of transition paths in complex atomic scale systems is addressed in the context of misfit dislocation formation in a strained Ge film on Si(001). Such paths contain multiple intermediate minima connected by minimum…

材料科学 · 物理学 2016-06-22 Emile Maras , Oleg Trushin , Alexander Stukowski , Tapio Ala-Nissila , Hannes Jonsson

In this paper, we present an automated parameter optimization method for trajectory generation. We formulate parameter optimization as a constrained optimization problem that can be effectively solved using Bayesian optimization. While the…

机器人学 · 计算机科学 2023-02-28 Max Spahn , Javier Alonso-Mora

Structural transformations at interfaces are of profound fundamental interest as complex examples of phase transitions in low-dimensional systems. Despite decades of extensive research, no compelling evidence exists for structural…

材料科学 · 物理学 2013-05-28 Timofey Frolov , David L. Olmsted , Mark Asta , Yuri Mishin

Practical success of quantum learning models hinges on having a suitable structure for the parameterized quantum circuit. Such structure is defined both by the types of gates employed and by the correlations of their parameters. While much…

量子物理 · 物理学 2024-02-29 Frederic Sauvage , Martin Larocca , Patrick J. Coles , M. Cerezo

The problem of path generation for the spherical 4R mechanism is solved using the Differential Evolution algorithm (DE). Formulas for the spherical geodesics are employed in order to obtain the parametric equation for the generated…

计算工程、金融与科学 · 计算机科学 2012-09-06 F. Penunuri , R. Peon-Escalante , C. Villanueva , Carlos A. Cruz-Villar

Topology Optimization seeks to find the best design that satisfies a set of constraints while maximizing system performance. Traditional iterative optimization methods like SIMP can be computationally expensive and get stuck in local…

机器学习 · 计算机科学 2023-03-20 Giorgio Giannone , Faez Ahmed

Several types of numerical and combinatorial optimization algorithms have been used as useful tools to minimize functional forms. Generally, when those forms are non-linear or occur in problems without a specific optimization method,…

化学物理 · 物理学 2007-05-23 Luiz Fernando Roncaratti , Ricardo Gargano , Geraldo Magela e Silva

We perform a systematic symmetry classification of the Markov generators of classical stochastic processes. Our classification scheme is based on the action of involutive symmetry transformations of a real Markov generator, extending the…

统计力学 · 物理学 2025-03-13 Lucas Sá , Pedro Ribeiro , Tomaž Prosen , Denis Bernard

Random geometric graphs (RGG) can be formalized as hidden-variables models where the hidden variables are the coordinates of the nodes. Here we develop a general approach to extract the typical configurations of a generic hidden-variables…

无序系统与神经网络 · 物理学 2015-04-28 Massimo Ostilli , Ginestra Bianconi

This paper proposes an optimal allocation problem with ramified transport technology in a spatial economy. Ramified transportation is used to model the transport economy of scale in group transportation observed widely in both nature and…

最优化与控制 · 数学 2021-09-02 Qinglan Xia , Shaofeng Xu

There has been a recent revolution in the ability to manipulate micrometer-sized objects on surfaces patterned by traps or obstacles of controllable configurations and shapes. One application of this technology is to separate particles…

软凝聚态物质 · 物理学 2009-11-11 James P. Gleeson , J. M. Sancho , A. M. Lacasta , Katja Lindenberg

The concept of programmable matter envisions a very large number of tiny and simple robot particles forming a smart material. Even though the particles are restricted to local communication, local movement, and simple computation, their…

分布式、并行与集群计算 · 计算机科学 2026-02-04 Irina Kostitsyna , Tom Peters , Bettina Speckmann