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In this paper we investigate the performance of different machine learning potentials (MLPs) in predicting key thermodynamic properties of water using RPBE+D3. Specifically, we scrutinize kernel-based regression and high-dimensional neural…

The classification of the optical spectra of active galactic nuclei (AGN) into different types is well founded on AGN physics, but it involves some degree of human oversight and cannot be reliably scaled to large data sets. Machine learning…

星系天体物理 · 物理学 2021-08-04 T. Peruzzi , M. Pasquato , S. Ciroi , M. Berton , P. Marziani , E. Nardini

In context of the universal presence of defects in additively manufactured (AM) metals, efficient computational tools are required to rapidly screen AM microstructures for mechanical integrity. To this end, a deep learning approach is used…

材料科学 · 物理学 2021-05-25 Brendan P. Croom , Michael Berkson , Robert K. Mueller , Michael Presley , Steven Storck

Characterizing and predicting the training performance of modern machine learning (ML) workloads on compute systems with compute and communication spread between CPUs, GPUs, and network devices is not only the key to optimization and…

分布式、并行与集群计算 · 计算机科学 2024-11-27 Zhongyi Lin , Ning Sun , Pallab Bhattacharya , Xizhou Feng , Louis Feng , John D. Owens

As artificial intelligence (AI) and machine learning (ML) technologies disrupt a wide range of industries, cloud datacenters face ever-increasing demand in inference workloads. However, conventional CPU-based servers cannot handle excessive…

硬件体系结构 · 计算机科学 2022-06-08 Jung-Hoon Kim , Sungyeob Yoo , Seungjae Moon , Joo-Young Kim

The increasing scale and complexity of global supply chains have led to new challenges spanning various fields, such as supply chain disruptions due to long waiting lines at the ports, material shortages, and inflation. Coupled with the…

机器学习 · 计算机科学 2025-07-24 Haibo Wang , Lutfu S. Sua , Bahram Alidaee

Modeling parameters are essential to the fidelity of nonlinear models of concrete structures subjected to earthquake ground motions, especially when simulating seismic events strong enough to cause collapse. This paper addresses two of the…

Artificial intelligence (AI) is increasingly used in the automotive industry for applications such as driving style classification, which aims to improve road safety, efficiency, and personalize user experiences. While deep learning (DL)…

This paper discusses pairing double/debiased machine learning (DDML) with stacking, a model averaging method for combining multiple candidate learners, to estimate structural parameters. In addition to conventional stacking, we consider two…

计量经济学 · 经济学 2024-09-27 Achim Ahrens , Christian B. Hansen , Mark E. Schaffer , Thomas Wiemann

In modern wireless communication systems, radio propagation modeling to estimate pathloss has always been a fundamental task in system design and optimization. The state-of-the-art empirical propagation models are based on measurements in…

网络与互联网体系结构 · 计算机科学 2022-02-08 Usama Masood , Hasan Farooq , Ali Imran , Adnan Abu-Dayya

Accuracy of molecular dynamics simulations depends crucially on the interatomic potential used to generate forces. The gold standard would be first-principles quantum mechanics (QM) calculations, but these become prohibitively expensive at…

The adaptability of the convolutional neural network (CNN) technique for aerodynamic meta-modeling tasks is probed in this work. The primary objective is to develop suitable CNN architecture for variable flow conditions and object geometry,…

机器学习 · 统计学 2018-01-18 Yao Zhang , Woong-Je Sung , Dimitri Mavris

This paper presents a serverless MLOps framework orchestrating the complete ML lifecycle from data ingestion, training, deployment, monitoring, and retraining to using event-driven pipelines and managed services. The architecture is…

Model agnostic meta-learning (MAML) is a popular state-of-the-art meta-learning algorithm that provides good weight initialization of a model given a variety of learning tasks. The model initialized by provided weight can be fine-tuned to…

机器学习 · 计算机科学 2021-06-11 Thanh Nguyen , Tung Luu , Trung Pham , Sanzhar Rakhimkul , Chang D. Yoo

Accurate load forecasting is crucial for maintaining the power balance between generators and consumers,particularly with the increasing integration of renewable energy sources, which introduce significant intermittent volatility. With the…

系统与控制 · 电气工程与系统科学 2024-09-04 Mingyang Gao , Suyang Zhou , Wei Gu , Zhi Wu , Haiquan Liu , Aihua Zhou

The limited extrapolative power of structure-based machine learning (ML) models is a critical bottleneck in chemical discovery, particularly for industrial R&D, where navigating uncharted chemical space to find next-generation materials or…

Although the tailored metal active sites and porous architectures of MOFs hold great promise for engineering challenges ranging from gas separations to catalysis, a lack of understanding of how to improve their stability limits their use in…

材料科学 · 物理学 2021-06-28 Aditya Nandy , Chenru Duan , Heather J. Kulik

Machine learning (ML) has become an integral component of high energy physics data analyses and is likely to continue to grow in prevalence. Physicists are incorporating ML into many aspects of analysis, from using boosted decision trees to…

高能物理 - 实验 · 物理学 2024-01-04 Elliott Kauffman , Alexander Held , Oksana Shadura

Accurate short-term forecasting of hauling-fleet capacity is crucial in open-pit mining, where weather fluctuations, mechanical breakdowns, and variable crew availability introduce significant operational uncertainties. We propose a…

机器学习 · 计算机科学 2025-06-06 N Guerin , M Nakhla , A Dehoux , J L Loyer

Credit risk default prediction remains a cornerstone of risk management in the financial industry. The task involves estimating the likelihood that a borrower will fail to meet debt obligations, an objective critical for lending decisions,…

机器学习 · 计算机科学 2026-04-21 Swattik Maiti , Ritik Pratap Singh , Fardina Fathmiul Alam