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Machine learning (ML) based interatomic potentials are emerging tools for materials simulations but require a trade-off between accuracy and speed. Here we show how one can use one ML potential model to train another: we use an existing,…

Materials Science · Physics 2022-09-20 Joe D. Morrow , Volker L. Deringer

Convolutional neural networks have been widely deployed in various application scenarios. In order to extend the applications' boundaries to some accuracy-crucial domains, researchers have been investigating approaches to boost accuracy…

Machine Learning · Computer Science 2019-05-21 Linfeng Zhang , Jiebo Song , Anni Gao , Jingwei Chen , Chenglong Bao , Kaisheng Ma

Recently, deep learning technology has been successfully introduced into Automatic Modulation Recognition (AMR) tasks. However, the success of deep learning is all attributed to the training on large-scale datasets. Such a large amount of…

Machine Learning · Computer Science 2024-08-07 Dongwei Xu , Jiajun Chen , Yao Lu , Tianhao Xia , Qi Xuan , Wei Wang , Yun Lin , Xiaoniu Yang

Synthesizing new materials efficiently is highly demanded in various research fields. However, this process is usually slow and expensive, especially for metallic glasses, whose formation strongly depends on the optimal combinations of…

Machine Learning · Computer Science 2025-11-18 K. -C. Ouyang , S. -Y. Zhang , S. -L. Liu , J. Tian , Y. -H. Li , H. Tong , H. -Y. Bai , W. -H. Wang , Y. -C. Hu

Dataset distillation aims to learn a small synthetic dataset that preserves most of the information from the original dataset. Dataset distillation can be formulated as a bi-level meta-learning problem where the outer loop optimizes the…

Machine Learning · Computer Science 2022-10-25 Yongchao Zhou , Ehsan Nezhadarya , Jimmy Ba

Word-embeddings are vital components of Natural Language Processing (NLP) models and have been extensively explored. However, they consume a lot of memory which poses a challenge for edge deployment. Embedding matrices, typically, contain…

Computation and Language · Computer Science 2020-11-12 Vasileios Lioutas , Ahmad Rashid , Krtin Kumar , Md Akmal Haidar , Mehdi Rezagholizadeh

Deep Neural Networks (DNNs) have achieved notable performance in the fields of computer vision and natural language processing with various applications in both academia and industry. However, with recent advancements in DNNs and…

The large memory and computation consumption in convolutional neural networks (CNNs) has been one of the main barriers for deploying them on resource-limited systems. To this end, most cheap convolutions (e.g., group convolution, depth-wise…

Computer Vision and Pattern Recognition · Computer Science 2019-10-11 Jiao Xie , Shaohui Lin , Yichen Zhang , Linkai Luo

While deep learning techniques have proven successful in image-related tasks, the exponentially increased data storage and computation costs become a significant challenge. Dataset distillation addresses these challenges by synthesizing…

Computer Vision and Pattern Recognition · Computer Science 2024-09-09 Zhe Li , Weitong Zhang , Sarah Cechnicka , Bernhard Kainz

Dataset distillation has emerged as a strategy to overcome the hurdles associated with large datasets by learning a compact set of synthetic data that retains essential information from the original dataset. While distilled data can be used…

Machine Learning · Computer Science 2024-07-23 William Yang , Ye Zhu , Zhiwei Deng , Olga Russakovsky

Knowledge distillation has become one of the most important model compression techniques by distilling knowledge from larger teacher networks to smaller student ones. Although great success has been achieved by prior distillation methods…

Machine Learning · Computer Science 2021-08-31 Yuzhang Shang , Bin Duan , Ziliang Zong , Liqiang Nie , Yan Yan

Integrating the structural inductive biases of Graph Neural Networks (GNNs) with the global contextual modeling capabilities of Transformers represents a pivotal challenge in graph representation learning. While GNNs excel at capturing…

Machine Learning · Computer Science 2025-03-05 Zhihua Duan , Jialin Wang

Large-scale datasets are usually required to train deep neural networks, but it increases the computational complexity hindering the practical applications. Recently, dataset distillation for images and texts has been attracting a lot of…

Computer Vision and Pattern Recognition · Computer Science 2025-12-16 Jae-Young Yim , Dongwook Kim , Jae-Young Sim

Normalizing flows are a powerful class of generative models demonstrating strong performance in several speech and vision problems. In contrast to other generative models, normalizing flows are latent variable models with tractable…

Machine Learning · Computer Science 2021-08-06 Dmitry Baranchuk , Vladimir Aliev , Artem Babenko

Artificial neural networks (NNs) are one of the most frequently used machine learning approaches to construct interatomic potentials and enable efficient large-scale atomistic simulations with almost ab initio accuracy. However, the…

Computational Physics · Physics 2021-10-05 Viktor Zaverkin , David Holzmüller , Ingo Steinwart , Johannes Kästner

Dataset distillation compresses large training sets into compact synthetic datasets while preserving downstream performance. As modern systems increasingly operate on paired vision-language inputs, multimodal distillation must preserve…

Computer Vision and Pattern Recognition · Computer Science 2026-05-25 Jongoh Jeong , Hoyong Kwon , Minseok Kim , Kuk-Jin Yoon

Many important multi-component crystalline solids undergo mechanochemical spinodal decomposition: a phase transformation in which the compositional redistribution is coupled with structural changes of the crystal, resulting in dynamically…

Computational Engineering, Finance, and Science · Computer Science 2023-07-19 Xiaoxuan Zhang , Krishna Garikipati

Knowledge Distillation (KD) has been one of the most popu-lar methods to learn a compact model. However, it still suffers from highdemand in time and computational resources caused by sequential train-ing pipeline. Furthermore, the soft…

Computer Vision and Pattern Recognition · Computer Science 2020-08-28 Benlin Liu , Yongming Rao , Jiwen Lu , Jie Zhou , Cho-jui Hsieh

Inorganic crystal materials have broad application potential due to excellent physical and chemical properties, with elastic properties (shear modulus, bulk modulus) crucial for predicting materials' electrical conductivity, thermal…

Materials Science · Physics 2025-11-07 Yujie Liu , Zhenyu Wang , Hang Lei , Guoyu Zhang , Jiawei Xian , Zhibin Gao , Jun Sun , Haifeng Song , Xiangdong Ding

Machine learning potentials (MLPs) for atomistic simulations have an enormous prospective impact on materials modeling, offering orders of magnitude speedup over density functional theory (DFT) calculations without appreciably sacrificing…

Materials Science · Physics 2022-01-20 Dylan Bayerl , Christopher M. Andolina , Shyam Dwaraknath , Wissam A. Saidi
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