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Batteries are critical for electrified transportation and aviation, yet thermodynamic understanding of electrode materials remains lacking, as indicated by the often-seen violation of the second law of thermodynamics of open-circuit voltage…

Chemical Physics · Physics 2025-07-16 Archie Mingze Yao , Amal Sebastian , Venkatasubramaian Viswanathan

By formulating data samples' formation as a Markov denoising process, diffusion models achieve state-of-the-art performances in a collection of tasks. Recently, many variants of diffusion models have been proposed to enable controlled…

Machine Learning · Computer Science 2023-04-17 Hengtong Zhang , Tingyang Xu

In High Energy Physics simulations play a crucial role in unraveling the complexities of particle collision experiments within CERN's Large Hadron Collider. Machine learning simulation methods have garnered attention as promising…

Data Analysis, Statistics and Probability · Physics 2024-06-06 Mikołaj Kita , Jan Dubiński , Przemysław Rokita , Kamil Deja

Thermoelectric (TE) materials are among very few sustainable yet feasible energy solutions of present time. This huge promise of energy harvesting is contingent on identifying/designing materials having higher efficiency than presently…

The ability to generate physically plausible ensembles of variable sources is critical to the optimization of time-domain survey cadences and the training of classification models on datasets with few to no labels. Traditional data…

Instrumentation and Methods for Astrophysics · Physics 2020-05-19 Jorge Martínez-Palomera , Joshua S. Bloom , Ellianna S. Abrahams

The fundamental quantity governing the mechanical and thermodynamic properties of a crystalline solid is its electronic charge density. Yet, its direct use for the rapid prediction of materials properties remains challenging due to its high…

Materials Science · Physics 2026-05-11 Kammampati Sai Kumar , Albert Linda , Shubham Kumar Maurya , Somnath Bhowmick

Microdischarges formed in bubbles immersed in liquids are of interest for materials synthesis and chemical conversion applications in the frame of plasma-driven electrochemistry. A key challenge associated with controlling such processes is…

Physical learning is an emerging paradigm in science and engineering whereby (meta)materials acquire desired macroscopic behaviors by exposure to examples. So far, it has been applied to static properties such as elastic moduli and…

The transition to intelligent, low-carbon power systems necessitates advanced optimization strategies for managing renewable energy integration, energy storage, and carbon emissions. Generative Large Models (GLMs) provide a data-driven…

Systems and Control · Electrical Eng. & Systems 2025-04-07 Lu Cheng , Qixiu Zhang , Beibei Xu , Zhiwei Huang , Cirun Zhang , Yanan Lyu , Fan Zhang

Recent advances in machine learning have opened new avenues for optimizing detector designs in high-energy physics, where the complex interplay of geometry, materials, and physics processes has traditionally posed a significant challenge.…

Recent advances in artificial intelligence have propelled the development of innovative computational materials modeling and design techniques. Generative deep learning models have been used for molecular representation, discovery, and…

Chemical Physics · Physics 2021-02-12 Navid Shervani-Tabar , Nicholas Zabaras

Modeling spatial heterogeneity and associated critical transitions remains a fundamental challenge in geography and environmental science. While conventional Geographically Weighted Regression (GWR) and deep learning models have improved…

Artificial Intelligence · Computer Science 2026-04-07 Sooyoung Lim , Zhenlong Li , Zi-Kui Liu

Diffusion model, the state-of-the-art generative machine learning architecture, has shown promising results airfoil inverse designs. In this study, we implemented and trained a series of diffusion models on three different airfoil geometry…

Fluid Dynamics · Physics 2026-01-26 Yingfan Geng , Jinhong Wang , Teng Cao

Computational Fluid Dynamics (CFD) plays a pivotal role in fluid mechanics, enabling precise simulations of fluid behavior through partial differential equations (PDEs). However, traditional CFD methods are resource-intensive, particularly…

Computational Engineering, Finance, and Science · Computer Science 2025-02-06 Tiffany Fan , Murray Cutforth , Marta D'Elia , Alexandre Cortiella , Alireza Doostan , Eric Darve

For a considerable time, researchers have focused on developing a method that establishes a deep connection between the generative diffusion model and mathematical physics. Despite previous efforts, progress has been limited to the pursuit…

Computer Vision and Pattern Recognition · Computer Science 2023-04-11 Weiyang Jin , Yongpei Zhu , Yuxi Peng

We have developed a new data-driven paradigm for the rapid inference, modeling and simulation of the physics of transport phenomena by deep learning. Using conditional generative adversarial networks (cGAN), we train models for the direct…

Machine Learning · Computer Science 2017-09-11 Amir Barati Farimani , Joseph Gomes , Vijay S. Pande

Accurate and efficient aeroelastic models are critically important for enabling the optimization and control of highly flexible aerospace structures, which are expected to become pervasive in future transportation and energy systems.…

Fluid Dynamics · Physics 2021-04-28 Nicola Fonzi , Steven L. Brunton , Urban Fasel

We address the problem of 2D particle density control. The particles are immersed in dielectric fluid and acted upon by manipulating an electric field. The electric field is controlled by an array of electrodes and used to bring the…

Optimization and Control · Mathematics 2022-09-09 Ion Matei , Johan de Kleer , Maksym Zhenirovskyy

Model-free reinforcement learning has emerged as a powerful method for developing robust robot control policies capable of navigating through complex and unstructured terrains. The effectiveness of these methods hinges on two essential…

Robotics · Computer Science 2024-10-15 Youwei Yu , Junhong Xu , Lantao Liu

The design of aerodynamic shapes, such as airfoils, has traditionally required significant computational resources and relied on predefined design parameters, which limit the potential for novel shape synthesis. In this work, we introduce a…

Machine Learning · Computer Science 2024-12-19 Reid Graves , Amir Barati Farimani
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