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The rapid advancements in artificial intelligence (AI), particularly the Large Language Models (LLMs), have profoundly affected our daily work and communication forms. However, it is still a challenge to deploy LLMs on resource-constrained…

Hardware Architecture · Computer Science 2025-03-03 Mingqiang Huang , Ao Shen , Kai Li , Haoxiang Peng , Boyu Li , Yupeng Su , Hao Yu

The latest HV-CMOS pixel sensor developed by the former CERN-RD50-CMOS group, known as the \mpw, demonstrates competitive radiation tolerance, spatial granularity, and timing resolution -- key requirements for future high-energy physics…

Experimental multi-parameter optimization can enhance the interfacing of cold atoms with waveguides and cavities. Recent implementations of machine learning (ML) algorithms demonstrate the optimization of complex cold atom ex perimental…

Atomic Physics · Physics 2025-07-16 Paul Anderson , Sreesh Venuturumilli , Michal Bajcsy

We present a machine learning (ML) method for predicting electronic structure correlation energies using Hartree-Fock input.The total correlation energy is expressed in terms of individual and pair contributions from occupied molecular…

Chemical Physics · Physics 2018-10-16 Matthew Welborn , Lixue Cheng , Thomas F. Miller

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

Machine learning (ML) plays an increasingly important role in both online and offline event reconstruction and identification at CMS experiment. A variety of ML techniques are used to improve the identification of physics objects. Dedicated…

High Energy Physics - Experiment · Physics 2026-02-10 Uttiya Sarkar

Currently, machine learning (ML) methods are widely used to process the results of physical experiments. In some cases, due to the limited amount of experimental data, ML-models can be pre-trained on synthetic data simulated based on the…

Computational Physics · Physics 2022-09-22 Y. R. Rodimkov , V. D. Volokitin , I. B. Meyerov , E. S. Efimenko

Modeling non-empirical and highly flexible interatomic potential energy surfaces (PES) using machine learning (ML) approaches is becoming popular in molecular and materials research. Training an ML-PES is typically performed in two stages:…

Materials Science · Physics 2021-01-05 Suresh Kondati Natarajan , Miguel A. Caro

We study collaborative machine learning (ML) across wireless devices, each with its own local dataset. Offloading these datasets to a cloud or an edge server to implement powerful ML solutions is often not feasible due to latency, bandwidth…

Machine Learning · Computer Science 2019-09-06 Mehdi Salehi Heydar Abad , Emre Ozfatura , Deniz Gunduz , Ozgur Ercetin

Intrinsically low lattice thermal conductivity ($\kappa_l$) is a desired requirement in many crystalline solids such as thermal barrier coatings and thermoelectrics. Here, we design an advanced machine-learning (ML) model based on crystal…

Materials Science · Physics 2021-09-09 Koushik Pal , Cheol Woo Park , Yi Xia , Jiahong Shen , Chris Wolverton

Photoactive iridium complexes are of broad interest due to their applications ranging from lighting to photocatalysis. However, the excited state property prediction of these complexes challenges ab initio methods such as time-dependent…

Chemical Physics · Physics 2022-09-20 Gianmarco Terrones , Chenru Duan , Aditya Nandy , Heather J. Kulik

Reliable operation of high-power proton cyclotrons is a critical requirement for Accelerator Driven Systems (ADS) and other large-scale applications. Beam tuning in such machines is traditionally performed manually, a process that can be…

Photonic computing chips have made significant progress in accelerating linear computations, but nonlinear computations are usually implemented in the digital domain, which introduces additional system latency and power consumption, and…

Transitioning from fossil fuels to renewable energy sources is a critical global challenge; it demands advances at the levels of materials, devices, and systems for the efficient harvesting, storage, conversion, and management of renewable…

Near-field radio holography is a common method for measuring and aligning mirror surfaces for millimeter and sub-millimeter telescopes. In instruments with more than a single mirror, degeneracies arise in the holography measurement,…

A large language model (LLM) is one of the most important emerging machine learning applications nowadays. However, due to its huge model size and runtime increase of the memory footprint, LLM inferences suffer from the lack of memory…

Hardware Architecture · Computer Science 2025-04-22 Soojin Hwang , Jungwoo Kim , Sanghyeon Lee , Hongbeen Kim , Jaehyuk Huh

We address the degree to which machine learning can be used to accurately and transferably predict post-Hartree-Fock correlation energies. Refined strategies for feature design and selection are presented, and the molecular-orbital-based…

Chemical Physics · Physics 2019-04-17 Lixue Cheng , Matthew Welborn , Anders S. Christensen , Thomas F. Miller

We develop a combined machine learning (ML) and quantum mechanics approach that enables data-efficient reconstruction of flexible molecular force fields from high-level ab initio calculations, through the consideration of fundamental…

Computational Physics · Physics 2021-04-14 Stefan Chmiela , Huziel E. Sauceda , Alexandre Tkatchenko , Klaus-Robert Müller

Machine-learned interatomic potentials can offer near first-principles accuracy but are computationally expensive, limiting their application to large-scale molecular dynamics simulations. Inspired by quantum mechanics/molecular mechanics…

Materials Science · Physics 2025-11-21 Fraser Birks , Matthew Nutter , Thomas D Swinburne , James R Kermode

Machine learning (ML) techniques have been demonstrated to improve the accuracy and efficiency of anomaly detection (AD) when compared to conventional methods. This has led to the adoption of ML for data quality monitoring (DQM) use cases…