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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…

Computational Physics · Physics 2021-01-07 Rhys E. A. Goodall , Alpha A. Lee

Quantum Computing and especially Quantum Machine Learning, in a short period of time, has gained a lot of interest through research groups around the world. This can be seen in the increasing number of proposed models for pattern…

Quantum Physics · Physics 2020-12-23 Héctor Iván García Hernández , Raymundo Torres Ruiz , Guo-Hua Sun

Semiconductor crosshatch patterns in thin film heterostructures form as a result of strain relaxation processes and dislocation pile-ups during growth of lattice mismatched materials. Due to their connection with the internal misfit…

Amorphous silicon (a-Si) is a widely studied non-crystalline material, and yet the subtle details of its atomistic structure are still unclear. Here, we show that accurate structural models of a-Si can be obtained by harnessing the power of…

A very active area of materials research is to devise methods that use machine learning to automatically extract predictive models from existing materials data. While prior examples have demonstrated successful models for some applications,…

Materials Science · Physics 2016-08-29 Logan Ward , Ankit Agrawal , Alok Choudhary , Christopher Wolverton

Protein structure determination has long been one of the primary challenges of structural biology, to which deep machine learning (ML)-based approaches have increasingly been applied. However, these ML models generally do not incorporate…

Biological Physics · Physics 2025-11-14 Tom Pan , Evan Dramko , Mitchell D. Miller , Anastasios Kyrillidis , George N. Phillips

Algorithms based on deep network models are being used for many pattern recognition and decision-making tasks in robotics and AI. Training these models requires a large labeled dataset and considerable computational resources, which are not…

Artificial Intelligence · Computer Science 2022-01-26 Mohan Sridharan , Tiago Mota

Laser cutting is a widely adopted technology in material processing across various industries, but it generates a significant amount of dust, smoke, and aerosols during operation, posing a risk to both the environment and workers' health.…

Computer Vision and Pattern Recognition · Computer Science 2025-11-21 Mohamed Abdallah Salem , Hamdy Ahmed Ashur , Ahmed Elshinnawy

The robust and automated determination of crystal symmetry is of utmost importance in material characterization and analysis. Recent studies have shown that deep learning (DL) methods can effectively reveal the correlations between X-ray or…

Computational Physics · Physics 2020-05-27 Leslie Ching Ow Tiong , Jeongrae Kim , Sang Soo Han , Donghun Kim

Machine Learning (ML) is accelerating the progress of materials prediction and classification, with particular success in CGNN designs. While classical ML methods remain accessible, advanced deep networks are still challenging to build and…

Other Condensed Matter · Physics 2025-02-04 Gavin Nop , Micah Mundy , Durga Paudyal , Jonathan Smith

Images of line drawings are generally composed of primitive elements. One of the most fundamental elements to characterize images is the topology; line segments belong to a category different from closed circles, and closed circles with…

Machine Learning · Computer Science 2019-08-02 Kenji Fukushima , Shotaro Shiba Funai , Hideaki Iida

To simplify the parameter of the deep learning network, a cascaded compressive sensing model "CSNet" is implemented for image classification. Firstly, we use cascaded compressive sensing network to learn feature from the data. Secondly,…

Computer Vision and Pattern Recognition · Computer Science 2014-09-26 Yufei Gan , Tong Zhuo , Chu He

One emerging application of machine learning methods is the inference of galaxy cluster masses. In this note, machine learning is used to directly combine five simulated multiwavelength measurements in order to find cluster masses. This is…

Cosmology and Nongalactic Astrophysics · Physics 2020-01-08 J. D. Cohn , Nicholas Battaglia

The expansiveness of compositional phase space is too vast to fully search using current theoretical tools for many emergent problems in condensed matter physics. The reliance on a deep chemical understanding is one method to identify local…

Superconductivity · Physics 2023-01-26 Lazar Novakovic , Ashkan Salamat , Keith V. Lawler

Machine learning (ML) models for electronic structure typically rely on large datasets generated by computationally expensive Kohn-Sham density functional theory calculations, as it is not known a priori which portions of the data are…

Recently, advances in machine learning techniques have attracted the attention of the research community to build intrusion detection systems (IDS) that can detect anomalies in the network traffic. Most of the research works, however, do…

Cryptography and Security · Computer Science 2018-12-14 Tara Salman , Deval Bhamare , Aiman Erbad , Raj Jain , Mohammed Samaka

Image segmentation is the problem of partitioning an image into different subsets, where each subset may have a different characterization in terms of color, intensity, texture, and/or other features. Segmentation is a fundamental component…

Computer Vision and Pattern Recognition · Computer Science 2015-11-03 M. Abdelsamea

Predicting the structure of multi-protein complexes is a grand challenge in biochemistry, with major implications for basic science and drug discovery. Computational structure prediction methods generally leverage pre-defined structural…

Biomolecules · Quantitative Biology 2021-01-26 Stephan Eismann , Raphael J. L. Townshend , Nathaniel Thomas , Milind Jagota , Bowen Jing , Ron O. Dror

Machine learning in atomistic materials science has grown to become a powerful tool, with most approaches focusing on atomic arrangements, typically decomposed into local atomic environments. This approach, while well-suited for…

Materials Science · Physics 2025-03-12 Austin Zadoks , Antimo Marrazzo , Nicola Marzari

Convolutional neural networks (CNNs) are one of the most successful computer vision systems to solve object recognition. Furthermore, CNNs have major applications in understanding the nature of visual representations in the human brain. Yet…

Computer Vision and Pattern Recognition · Computer Science 2022-12-13 Amr Farahat , Felix Effenberger , Martin Vinck