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We employ a descriptor based machine-learning approach to assess the effect of chemical alloying on formation-enthalpy of rare-earth intermetallics. Application of machine-learning approaches in rare-earth intermetallic design have been…

This study presents a multisensory machine learning architecture for object recognition by employing a novel dataset that was constructed with the iCub robot, which is equipped with three cameras and a depth sensor. The proposed…

机器人学 · 计算机科学 2020-09-15 Murat Kirtay , Guido Schillaci , Verena V. Hafner

Density functional theory and its optimization algorithm are the main methods to calculate the properties in the field of materials. Although the calculation results are accurate, it costs a lot of time and money. In order to alleviate this…

材料科学 · 物理学 2021-09-21 Houchen Zuo , Yongquan Jiang , Yan Yang , Jie Hu

With the rapid development of artificial intelligence, the combination of material database and machine learning has driven the progress of material informatics. Because aluminum alloy is widely used in many fields, so it is significant to…

材料科学 · 物理学 2022-07-05 Houchen Zuo , Yongquan Jiang , Yan Yang , Baoying Liu , Jie Hu

In this study, a machine learning-based technique is developed to reduce the computational cost required to explore large design spaces of substitutional alloys. The first advancement is based on a neural network approach to predict the…

计算物理 · 物理学 2020-04-03 Alhassan S. Yasin , Terence D. Musho

Noise has always been nonnegligible trouble in object detection by creating confusion in model reasoning, thereby reducing the informativeness of the data. It can lead to inaccurate recognition due to the shift in the observed pattern, that…

计算机视觉与模式识别 · 计算机科学 2023-04-25 Xinyu Zhang , Zhiwei Li , Zhenhong Zou , Xin Gao , Yijin Xiong , Dafeng Jin , Jun Li , Huaping Liu

Image-text contrastive pretraining has become a dominant paradigm for visual representation learning, yet existing methods often yield representations that remain partially organized by modality. We propose ITO, a framework addressing this…

计算机视觉与模式识别 · 计算机科学 2026-03-10 Hanpeng Liu , Yaqian Li , Zidan Wang , Shuoxi Zhang , Zonglin Zhao , Zihao Bo , Rinyoichi Takezoe , Kaiwen Long , Kun He

Mammalian brains handle complex reasoning tasks in a gestalt manner by integrating information from regions of the brain that are specialised to individual sensory modalities. This allows for improved robustness and better generalisation…

计算机视觉与模式识别 · 计算机科学 2020-11-20 Aiswarya Akumalla , Seth Haney , Maksim Bazhenov

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…

化学物理 · 物理学 2016-11-22 Sandip De , Felix Musil , Teresa Ingram , Carsten Baldauf , Michele Ceriotti

Structure-informed materials informatics is a rapidly evolving discipline of materials science relying on the featurization of atomic structures or configurations to construct vector, voxel, graph, graphlet, and other representations useful…

材料科学 · 物理学 2024-12-17 Adam M. Krajewski , Jonathan W. Siegel , Zi-Kui Liu

Most machine learning models for materials science rely on descriptors based on materials compositions and structures, even though the chemical bond has been proven to be a valuable concept for predicting materials properties. Over the…

Machine learning has the potential to accelerate materials discovery by accurately predicting materials properties at a low computational cost. However, the model inputs remain a key stumbling block. Current methods typically use…

计算物理 · 物理学 2021-01-07 Rhys E. A. Goodall , Alpha A. Lee

Infrared and visible image fusion is a powerful technique that combines complementary information from different modalities for downstream semantic perception tasks. Existing learning-based methods show remarkable performance, but are…

计算机视觉与模式识别 · 计算机科学 2023-08-09 Zhu Liu , Jinyuan Liu , Benzhuang Zhang , Long Ma , Xin Fan , Risheng Liu

Generative machine learning models have revolutionized material discovery by capturing complex structure-property relationships, yet extending these approaches to the inverse design of three-dimensional metamaterials remains limited by…

计算工程、金融与科学 · 计算机科学 2026-04-27 Li Zheng , Siddhant Kumar , Dennis M. Kochmann

To leverage advancements in machine learning for metallic materials design and property prediction, it is crucial to develop a data-reduced representation of metal microstructures that surpasses the limitations of current physics-based…

A dataset of 35,608 materials with their topological properties is constructed by combining the density functional theory (DFT) results of Materiae and the Topological Materials Database. Thanks to this, machine-learning approaches are…

Prediction of material property is a key problem because of its significance to material design and screening. We present a brand-new and general machine learning method for material property prediction. As a representative example, polymer…

机器学习 · 计算机科学 2022-03-01 Zhilong Liang , Zhiwei Li , Shuo Zhou , Yiwen Sun , Changshui Zhang , Jinying Yuan

As medical diagnoses increasingly leverage multimodal data, machine learning models are expected to effectively fuse heterogeneous information while remaining robust to missing modalities. In this work, we propose a novel multimodal…

计算机视觉与模式识别 · 计算机科学 2025-09-24 Yi Gu , Kuniaki Saito , Jiaxin Ma

In order to make accurate predictions of material properties, current machine-learning approaches generally require large amounts of data, which are often not available in practice. In this work, an all-round framework is presented which…

材料科学 · 物理学 2021-07-09 Pierre-Paul De Breuck , Geoffroy Hautier , Gian-Marco Rignanese

We propose an approach to materials prediction that uses a machine-learning interatomic potential to approximate quantum-mechanical energies and an active learning algorithm for the automatic selection of an optimal training dataset. Our…