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Calculating thermodynamic potentials and observables efficiently and accurately is key for the application of statistical mechanics simulations to materials science. However, naive Monte Carlo approaches, on which such calculations are…

Statistical Mechanics · Physics 2021-07-15 James Damewood , Daniel Schwalbe-Koda , Rafael Gomez-Bombarelli

Classical machine learning algorithms often face scalability bottlenecks when they are applied to large-scale data. Such algorithms were designed to work with small data that is assumed to fit in the memory of one machine. In this report,…

Distributed, Parallel, and Cluster Computing · Computer Science 2015-05-14 Tarek Elgamal , Mohamed Hefeeda

Supply chain network data is a valuable asset for businesses wishing to understand their ethical profile, security of supply, and efficiency. Possession of a dataset alone however is not a sufficient enabler of actionable decisions due to…

Machine Learning · Computer Science 2021-07-23 Ajmal Aziz , Edward Elson Kosasih , Ryan-Rhys Griffiths , Alexandra Brintrup

Principal components analysis (PCA) is a well-known technique for approximating a tabular data set by a low rank matrix. Here, we extend the idea of PCA to handle arbitrary data sets consisting of numerical, Boolean, categorical, ordinal,…

Machine Learning · Statistics 2015-05-06 Madeleine Udell , Corinne Horn , Reza Zadeh , Stephen Boyd

We consider multi-class classification problems for high dimensional data. Following the idea of reduced-rank linear discriminant analysis (LDA), we introduce a new dimension reduction tool with a flavor of supervised principal component…

Methodology · Statistics 2017-03-28 Yue Selena Niu , Ning Hao , Bin Dong

Quantifying the impacts of air pollution on health and climate relies on key atmospheric particle properties such as toxicity and hygroscopicity. However, these properties typically require complex observational techniques or expensive…

Machine Learning · Computer Science 2026-02-13 Fei Jiang , Jiyang Xia , Junjie Yu , Mingfei Sun , Hugh Coe , David Topping , Dantong Liu , Zhenhui Jessie Li , Zhonghua Zheng

ATLAS, a general-purpose experiment at the Large Hadron Collider (LHC), makes use of a large internationally-distributed computing infrastructure, including over $10^6$ TB of managed data on disk and tape and almost one million…

High Energy Physics - Experiment · Physics 2026-04-16 ATLAS Collaboration

The most recent concern of all people on Earth is the increase in the concentration of greenhouse gas in the atmosphere. The concentration of these gases has risen rapidly over the last century and if the trend continues it can cause many…

Machine Learning · Computer Science 2022-11-16 Samveg Shah , Shubham Thakar , Kashish Jain , Bhavya Shah , Sudhir Dhage

The availability of reliable, high-resolution climate and weather data is important to inform long-term decisions on climate adaptation and mitigation and to guide rapid responses to extreme events. Forecasting models are limited by…

This paper develops a novel, fully automated forecast averaging scheme, which combines LASSO estimation method with Principal Component Averaging (PCA). LASSO-PCA (LPCA) explores a pool of predictions based on a single model but calibrated…

Applications · Statistics 2024-04-09 Bartosz Uniejewski , Katarzyna Maciejowska

The transition to low-carbon energy systems demands comprehensive technical, economic, environmental, and social evaluation tools. While numerous studies address specific aspects of energy transition, few provide an integrated framework to…

Systems and Control · Electrical Eng. & Systems 2025-09-09 Jayashree Yadav , Ingemar Mathiasson , Bindu Panikkar , Mads Almassalkhi

A major challenge in modern reinforcement learning (RL) is efficient control of dynamical systems from high-dimensional sensory observations. Learning controllable embedding (LCE) is a promising approach that addresses this challenge by…

Machine Learning · Computer Science 2020-06-25 Brandon Cui , Yinlam Chow , Mohammad Ghavamzadeh

Greenhouse is an important protected horticulture system for feeding the world with enough fresh food. However, to maintain an ideal growing climate in a greenhouse requires resources and operational costs. In order to achieve economical…

Optimization and Control · Mathematics 2023-03-13 Bernardo Morcego , Wenjie Yin , Sjoerd Boersma , Eldert van Henten , Vicenç Puig , Congcong Sun

The environmental impact of Large Language Models (LLMs) on data centers hosting these models is becoming a significant concern. While many efforts have focused on reducing the substantial training overhead of LLMs, carbon and water…

Systems and Control · Electrical Eng. & Systems 2026-03-10 Arash Khalatbarisoltani , Amin Mahmoudi , Jie Han , Muhammad Saeed , Wenxue Liu , Jinwen Li , Solmaz Kahourzade , Amirmehdi Yazdani , Xiaosong Hu

In this paper, we apply the Logistic PCA (LPCA) as a dimensionality reduction tool for visualizing patterns and characterizing the relevance of mathematics abilities from a given population measured by a large-scale assessment. We establish…

Applications · Statistics 2020-06-02 Esdras Medeiros , Jorge Lira , Romildo Silva , Caio Azevedo

Promoting and increasing energy efficiency is a promising method of reducing CO2 emissions and avoiding the potentially devastating effects of climate change. The question is: How do we induce a cultural or behavioural change whereby people…

Physics and Society · Physics 2009-09-29 Federico Gallo , Pierluigi Contucci , Adam Coutts , Ignacio Gallo

Machine learning inference occurs at a massive scale, yet its environmental impact remains poorly quantified, especially on low-resource hardware. We present ML-EcoLyzer, a cross-framework tool for measuring the carbon, energy, thermal, and…

Machine Learning · Computer Science 2026-03-17 Jose Marie Antonio Minoza , Rex Gregor Laylo , Christian F Villarin , Sebastian C. Ibanez

Determining changes in global temperature and precipitation that may indicate climate change is complicated by annual variations. One approach for finding potential climate change indicators is to train a model that predicts the year from…

Atmospheric and Oceanic Physics · Physics 2022-12-09 Charles Anderson , Jason Stock

The rapid growth in demand for HPC systems has led to a rise in carbon footprint, which requires urgent intervention. In this work, we present a comprehensive analysis of the carbon footprint of high-performance computing (HPC) systems,…

Distributed, Parallel, and Cluster Computing · Computer Science 2023-11-21 Baolin Li , Rohan Basu Roy , Daniel Wang , Siddharth Samsi , Vijay Gadepally , Devesh Tiwari

There is a growing call for greater amounts of increasingly agile computational power for edge and cloud infrastructure to serve the computationally complex needs of ubiquitous computing devices. Thus, an important challenge is addressing…

Hardware Architecture · Computer Science 2023-12-07 Peipei Zhou , Jinming Zhuang , Stephen Cahoon , Yue Tang , Zhuoping Yang , Xingzhen Chen , Yiyu Shi , Jingtong Hu , Alex K. Jones