English
Related papers

Related papers: Modeling crystal defects using defect-informed neu…

200 papers

To solve high-dimensional parameter-dependent partial differential equations (pPDEs), a neural network architecture is presented. It is constructed to map parameters of the model data to corresponding finite element solutions. To improve…

Numerical Analysis · Mathematics 2024-03-20 Janina E. Schütte , Martin Eigel

We introduce Neural Deformation Graphs for globally-consistent deformation tracking and 3D reconstruction of non-rigid objects. Specifically, we implicitly model a deformation graph via a deep neural network. This neural deformation graph…

Computer Vision and Pattern Recognition · Computer Science 2020-12-04 Aljaž Božič , Pablo Palafox , Michael Zollhöfer , Justus Thies , Angela Dai , Matthias Nießner

Existing graph neural networks may suffer from the "suspended animation problem" when the model architecture goes deep. Meanwhile, for some graph learning scenarios, e.g., nodes with text/image attributes or graphs with long-distance node…

Machine Learning · Computer Science 2020-01-23 Jiawei Zhang

We present a data-enabled physics-informed neural network (DEPINN) with comprehensive numerical study for solving industrial scale neutron diffusion eigenvalue problems (NDEPs). In order to achieve an engineering acceptable accuracy for…

Computational Physics · Physics 2022-11-15 Yu Yang , Helin Gong , Shiquan Zhang , Qihong Yang , Zhang Chen , Qiaolin He , Qing Li

Developing accurate, transferable and computationally inexpensive machine learning models can rapidly accelerate the discovery and development of new materials. Some of the major challenges involved in developing such models are, (i)…

Crystal material representation is the foundation of crystal material research. Existing works consider crystal molecules as graph data with different representation methods and leverage the advantages of techniques in graph learning. A…

Materials Science · Physics 2023-12-27 Jiao Huang , Qianli Xing , Jinglong Ji , Bo Yang

Topological defects play a key role in the structures and dynamics of liquid crystals (LCs) and other ordered systems. There is a recent interest in studying defects in different biological systems with distinct textures. However, a robust…

Soft Condensed Matter · Physics 2025-01-20 Haijie Ren , Weiqiang Wang , Wentao Tang , Rui Zhang

Deep neural networks (DNNs) have achieved great success in the area of computer vision. The disparity estimation problem tends to be addressed by DNNs which achieve much better prediction accuracy in stereo matching than traditional…

Computer Vision and Pattern Recognition · Computer Science 2020-03-25 Qiang Wang , Shaohuai Shi , Shizhen Zheng , Kaiyong Zhao , Xiaowen Chu

Neural operators aim to learn mappings between infinite-dimensional function spaces, but their performance often degrades on complex or irregular geometries due to the lack of geometry-aware representations. We propose the Finite Element…

Numerical Analysis · Mathematics 2026-02-03 Shiyuan Li , Hossein Salahshoor

Accurate 3D reconstruction of deformable soft tissues is essential for surgical robotic perception. However, low-texture surfaces, specular highlights, and instrument occlusions often fragment geometric continuity, posing a challenge for…

Computer Vision and Pattern Recognition · Computer Science 2026-05-13 Falong Fan , Yi Xie , Arnis Lektauers , Bo Liu , Jerzy Rozenblit

With the feature size continuously shrinking in advanced technology nodes, mask optimization is increasingly crucial in the conventional design flow, accompanied by an explosive growth in prohibitive computational overhead in optical…

Computer Vision and Pattern Recognition · Computer Science 2023-03-23 Guojin Chen , Ziyang Yu , Hongduo Liu , Yuzhe Ma , Bei Yu

Due to limitations in acquisition equipment, noise perturbations often corrupt 3-D point clouds, hindering down-stream tasks such as surface reconstruction, rendering, and further processing. Existing 3-D point cloud denoising methods…

Computer Vision and Pattern Recognition · Computer Science 2024-11-22 Wenqiang Xu , Wenrui Dai , Duoduo Xue , Ziyang Zheng , Chenglin Li , Junni Zou , Hongkai Xiong

Continual shrinking of pattern dimensions in the semiconductor domain is making it increasingly difficult to inspect defects due to factors such as the presence of stochastic noise and the dynamic behavior of defect patterns and types.…

Computer Vision and Pattern Recognition · Computer Science 2023-08-16 Vic De Ridder , Bappaditya Dey , Enrique Dehaerne , Sandip Halder , Stefan De Gendt , Bartel Van Waeyenberge

Message-passing neural networks (MPNN) have shown extremely high efficiency and accuracy in predicting the physical properties of molecules and crystals, and are expected to become the next-generation material simulation tool after the…

Materials Science · Physics 2022-01-19 Yang Zhong , Hongyu Yu , Xingao Gong , Hongjun Xiang

Molecular property prediction is essential in a variety of contemporary scientific fields, such as drug development and designing energy storage materials. Although there are many machine learning models available for this purpose, those…

Machine Learning · Computer Science 2025-06-03 Gihan Panapitiya , Peiyuan Gao , C Mark Maupin , Emily G Saldanha

Site-Net is a transformer architecture that models the periodic crystal structures of inorganic materials as a labelled point set of atoms and relies entirely on global self-attention and geometric information to guide learning. Site-Net…

Materials Science · Physics 2022-09-20 Michael Moran , Michael W. Gaultois , Vladimir V. Gusev , Matthew J. Rosseinsky

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

In this paper, we propose an object reconstruction apparatus that uses the so-called Generic Primitives (GP) to complete shapes. A GP is a 3D point cloud depicting a generalized shape of a class of objects. To reconstruct the objects in a…

Computer Vision and Pattern Recognition · Computer Science 2020-06-04 Tiberiu Cocias , Alexandru Razvant , Sorin Grigorescu

Learning the physical dynamics of deformable objects with particle-based representation has been the objective of many computational models in machine learning. While several state-of-the-art models have achieved this objective in simulated…

Computer Vision and Pattern Recognition · Computer Science 2022-01-14 Jinhyung Park , DoHae Lee , In-Kwon Lee

We present a novel physics-informed deep learning framework for solving steady-state incompressible flow on multiple sets of irregular geometries by incorporating two main elements: using a point-cloud based neural network to capture…

Fluid Dynamics · Physics 2022-10-28 Ali Kashefi , Tapan Mukerji