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Grain boundary (GB) kinetics is important for many applications in 2d materials and metal thin films. To study how the substrate shape affects GB mobility and kinetics, we develop a kinetic Monte Carlo (kMC) simulation method and an…

Materials Science · Physics 2022-01-24 Kongtao Chen

Additively manufactured metals exhibit heterogeneous microstructure which dictates their material and failure properties. Experimental microstructural characterization techniques generate a large amount of data that requires expensive…

Image and Video Processing · Electrical Eng. & Systems 2021-05-10 Roberto Perera , Davide Guzzetti , Vinamra Agrawal

The relationship between bulk and boundary properties is one of the founding features of (Rational) Conformal Field Theory. Our goal in this paper is to explore the possibility of having an equivalent relationship in the context of lattice…

High Energy Physics - Theory · Physics 2022-11-29 Jonathan Belletête , Azat M. Gainutdinov , Jesper L. Jacobsen , Hubert Saleur , Romain Vasseur

Generative Adversarial Networks (GANs) are shown to be successful at generating new and realistic samples including 3D object models. Conditional GAN, a variant of GANs, allows generating samples in given conditions. However, objects…

Computer Vision and Pattern Recognition · Computer Science 2019-03-18 Cihan Öngün , Alptekin Temizel

This paper describes an interdisciplinary approach to geometry modeling of geospatial boundaries. The objective is to extract surfaces from irregular spatial patterns using differential geometry and obtain coherent directional predictions…

Computational Engineering, Finance, and Science · Computer Science 2020-06-09 Raymond Leung

Grain boundaries have extensive influence on the performance of crystal materials. However, the atomic-scale structure and its relation with local and crystallographic symmetries remain elusive in low-symmetry crystals. Herein, we find that…

Materials Science · Physics 2024-09-24 Yuchao Yan , Yingying Liu , Ziyi Wang , Da Liu , Xu Gao , Yan Wang , Cheng Li , KeKe Ma , Ning Xia , Zhu Jin , Tianqi Deng , Hui Zhang , Deren Yang

The study of defect phases is important for designing nanostructured metals and alloys. Grain boundaries (GBs) form one class of defects that directly influence materials properties, such as deformability and strength. At the same time,…

Materials Science · Physics 2023-03-20 P. Mathews , S. Zhang , C. Scheu , R. Janisch , J. Neugebauer , T. Hickel

Generative adversarial networks (GANs) are a learning framework that rely on training a discriminator to estimate a measure of difference between a target and generated distributions. GANs, as normally formulated, rely on the generated…

Machine Learning · Statistics 2018-02-23 R Devon Hjelm , Athul Paul Jacob , Tong Che , Adam Trischler , Kyunghyun Cho , Yoshua Bengio

Recent advances in the numerical representation of materials opened the way for successful machine learning of grain boundary (GB) energies and the classification of GB mobility and shear coupling. Two representations were needed for these…

Materials Science · Physics 2018-08-17 Conrad W. Rosenbrock , Jonathan L. Priedeman , Gus L. W. Hart , Eric R. Homer

We propose a new method for collision-free planning using Conditional Generative Adversarial Networks (cGANs) to transform between the robot's joint space and a latent space that captures only collision-free areas of the joint space,…

With the increasing availability of experimental and computational data concerning the properties and distribution of grain boundaries in polycrystalline materials, there is a corresponding need to efficiently and systematically express…

Materials Science · Physics 2019-09-27 Jeremy K. Mason , Srikanth Patala

Tilings of the hyperbolic plane are of significant interest among many branches of mathematics, physics and computer science. Yet, their construction remains a non-trivial task. Current approaches primarily use tree-based recursive…

Computational Physics · Physics 2025-08-08 Yanick Thurn , Manuel Schrauth , Johanna Erdmenger

We report significantly improved accuracy of grain boundary segmentation using Convolutional Neural Networks (CNN) trained on a combination of real and generated data. Manual segmentation is accurate but time-consuming, and existing…

One of the most pressing issues for loop quantum gravity and spin foams is the construction of the continuum limit. In this paper, we propose a systematic coarse-graining scheme for three-dimensional lattice gauge models including spin…

General Relativity and Quantum Cosmology · Physics 2017-11-22 Clement Delcamp , Bianca Dittrich

Linear modal analysis is a useful and effective tool for the design and analysis of structures. However, a comprehensive basis for nonlinear modal analysis remains to be developed. In the current work, a machine learning scheme is proposed…

Machine Learning · Computer Science 2022-03-03 G. Tsialiamanis , M. D. Champneys , N. Dervilis , D. J. Wagg , K. Worden

We pursue tractable Bayesian analysis of generalized linear models (GLMs) for categorical data. Thus far, GLMs are difficult to scale to more than a few dozen categories due to non-conjugacy or strong posterior dependencies when using…

Machine Learning · Statistics 2022-06-02 Michael T. Wojnowicz , Shuchin Aeron , Eric L. Miller , Michael C. Hughes

We propose GrainGNN, a surrogate model for the evolution of polycrystalline grain structure under rapid solidification conditions in metal additive manufacturing. High fidelity simulations of solidification microstructures are typically…

Computational Engineering, Finance, and Science · Computer Science 2024-02-02 Yigong Qin , Stephen DeWitt , Balasubramaniam Radhakrishnan , George Biros

Vision-based grasping of unknown objects in unstructured environments is a key challenge for autonomous robotic manipulation. A practical grasp synthesis system is required to generate a diverse set of 6-DoF grasps from which a…

Grain boundary (GB) segregation in magnesium (Mg) substantially influences its mechanical properties and performance. Atomic-scale modelling, typically using ab-initio or semi-empirical approaches, has mainly focused on GB segregation at…

Generative Bayesian Computation (GBC) methods are developed for Casual Inference. Generative methods are simulation-based methods that use a large training dataset to represent posterior distributions as a map (a.k.a. optimal transport) to…

Methodology · Statistics 2024-12-25 Maria Nareklishvili , Nicholas Polson , Vadim Sokolov