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Related papers: Simulating Charged Defects at Database Scale

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The prediction of upcoming events in industrial processes has been a long-standing research goal since it enables optimization of manufacturing parameters, planning of equipment maintenance and more importantly prediction and eventually…

Computer Vision and Pattern Recognition · Computer Science 2020-02-26 Nikolaos Dimitriou , Lampros Leontaris , Thanasis Vafeiadis , Dimosthenis Ioannidis , Tracy Wotherspoon , Gregory Tinker , Dimitrios Tzovaras

Machine-learning methods are nowadays of common use in the field of material science. For example, they can aid in optimizing the physicochemical properties of new materials, or help in the characterization of highly complex chemical…

Disordered Systems and Neural Networks · Physics 2022-11-29 Maciej J. Karcz , Luca Messina , Eiji Kawasaki , Serenah Rajaonson , Didier Bathellier , Emeric Bourasseau

The tunability of physical properties in transition metal dichalcogenides (TMDCs) through point defect engineering offers significant potential for the development of next-generation optoelectronic and high-tech applications. Building upon…

Materials Science · Physics 2025-01-30 Abdalaziz Al-Maeeni , Denis Derkach , Andrey Ustyuzhanin

Defect inspection is paramount within the closed-loop manufacturing system. However, existing datasets for defect inspection often lack precision and semantic granularity required for practical applications. In this paper, we introduce the…

Computer Vision and Pattern Recognition · Computer Science 2024-07-22 Shuai Yang , Zhifei Chen , Pengguang Chen , Xi Fang , Yixun Liang , Shu Liu , Yingcong Chen

The formation and subsequent growth of structural defects in an irradiated material can strongly influence the material's performance in technological and industrial applications. Predicting how the growth of defects affects material…

Technology to recognize the type of component represented by a point cloud is required in the reconstruction process of an as-built model of a process plant based on laser scanning. The reconstruction process of a process plant through…

Computer Vision and Pattern Recognition · Computer Science 2019-12-30 Hyungki Kim , Duhwan Mun

The stress-mediated diffusion of nonequilibrium point defects from the surface to the bulk of the semiconductor is investigated by computer simulation. It is supposed that point defects are generated in the surface region by ion…

Materials Science · Physics 2007-05-23 O. I. Velichko

3D scanning is a complex multistage process that generates a point cloud of an object typically containing damaged parts due to occlusions, reflections, shadows, scanner motion, specific properties of the object surface, imperfect…

Computer Vision and Pattern Recognition · Computer Science 2022-01-07 Taras Rumezhak , Oles Dobosevych , Rostyslav Hryniv , Vladyslav Selotkin , Volodymyr Karpiv , Mykola Maksymenko

In complex crystals close to melting or at finite temperatures, different types of defects are ubiquitous and their role becomes relevant in the mechanical response of these solids. Conventional elasticity theory fails to provide a…

Extended defects such as dislocation networks and general grain boundaries are ubiquitous in metals, and accurately modeling these extensive defects is crucial for understanding their deformation mechanisms. Existing machine learning…

Materials Science · Physics 2025-06-10 Fei Shuang , Kai Liu , Yucheng Ji , Wei Gao , Luca Laurenti , Poulumi Dey

High-throughput computational materials design promises to greatly accelerate the process of discovering new materials and compounds, and of optimizing their properties. The large databases of structures and properties that result from…

Chemical Physics · Physics 2016-11-22 Sandip De , Felix Musil , Teresa Ingram , Carsten Baldauf , Michele Ceriotti

The defect detection task can be regarded as a realistic scenario of object detection in the computer vision field and it is widely used in the industrial field. Directly applying vanilla object detector to defect detection task can achieve…

Computer Vision and Pattern Recognition · Computer Science 2021-08-11 Zhaoyang Zeng , Bei Liu , Jianlong Fu , Hongyang Chao

Modification of physical properties of materials and design of materials with on-demand characteristics is at the heart of modern technology. Rare application relies on pure materials--most devices and technologies require careful design of…

Modeling semicoherent metal-metal interfaces has so far been performed using atomistic simulations based on semiempirical interatomic potentials. We demonstrate through more precise ab-initio calculations that key conclusions drawn from…

Materials Science · Physics 2014-12-31 Erki Metsanurk , Alfredo Caro , Artur Tamm , Alvo Aabloo , Mattias Klintenberg

Rapid solidification leads to unique microstructural features, where a less studied topic is the formation of various crystalline defects, including high dislocation densities, as well as gradients and splitting of the crystalline…

Point cloud is an important type of geometric data structure. Due to its irregular format, most researchers transform such data to regular 3D voxel grids or collections of images. This, however, renders data unnecessarily voluminous and…

Computer Vision and Pattern Recognition · Computer Science 2017-04-12 Charles R. Qi , Hao Su , Kaichun Mo , Leonidas J. Guibas

Efficiently generating energetically stable crystal structures has long been a challenge in material design, primarily due to the immense arrangement of atoms in a crystal lattice. To facilitate the discovery of stable material, we present…

Artificial Intelligence · Computer Science 2025-09-30 Zhelin Li , Rami Mrad , Runxian Jiao , Guan Huang , Jun Shan , Shibing Chu , Yuanping Chen

Robust 3D perception under corruption has become an essential task for the realm of 3D vision. While current data augmentation techniques usually perform random transformations on all point cloud objects in an offline way and ignore the…

Computer Vision and Pattern Recognition · Computer Science 2023-09-20 Jie Wang , Lihe Ding , Tingfa Xu , Shaocong Dong , Xinli Xu , Long Bai , Jianan Li

This paper describes a prototype software and hardware platform to provide support to field operators during the inspection of surface defects of non-metallic pipes. Inspection is carried out by video filming defects created on the same…

Machine Learning · Computer Science 2022-12-12 Fabio Cacciatori , Sergei Nikolaev , Dmitrii Grigorev

Traditional defect prediction approaches often use metrics that measure the complexity of the design or implementing code of a software system, such as the number of lines of code in a source file. In this paper, we explore a different…

Software Engineering · Computer Science 2024-09-30 Hung Viet Pham , Tung Thanh Nguyen