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We present three different neural network algorithms to calculate thermodynamic properties as well as dynamic correlation functions at finite temperatures for quantum lattice models. The first method is based on purification, which allows…

Statistical Mechanics · Physics 2024-04-16 D. Wagner , A. Klümper , J. Sirker

With electric power systems becoming more compact and increasingly powerful, the relevance of thermal stress especially during overload operation is expected to increase ceaselessly. Whenever critical temperatures cannot be measured…

Machine Learning · Computer Science 2022-11-03 Wilhelm Kirchgässner , Oliver Wallscheid , Joachim Böcker

The number of electrified powertrains is ever increasing today towards a more sustainable future; thus, it is essential that unwanted failures are prevented, and a reliable operation is secured. Monitoring the internal temperatures of…

Machine Learning · Computer Science 2025-04-28 Dinan Li , Panagiotis Kakosimos

Machine learning thermodynamic perturbation theory (MLPT) is a promising approach to compute finite temperature properties when the goal is to compare several different levels of ab initio theory and/or to apply highly expensive…

In this work we offer a framework for reasoning about a wide class of existing objectives in machine learning. We develop a formal correspondence between this work and thermodynamics and discuss its implications.

Machine Learning · Computer Science 2018-10-08 Alexander A. Alemi , Ian Fischer

Equations of State model relations between thermodynamic variables and are ubiquitous in scientific modelling, appearing in modern day applications ranging from Astrophysics to Climate Science. The three desired properties of a general…

We introduce machine learning (ML) models that predict the electronic structure of materials across a wide temperature range. Our models employ neural networks and are trained on density functional theory (DFT) data. Unlike most other ML…

Materials Science · Physics 2023-10-02 Lenz Fiedler , Normand A. Modine , Kyle D. Miller , Attila Cangi

This work introduces an approach rooted in quantum thermodynamics to enhance sampling efficiency in quantum machine learning (QML). We propose conceptualizing quantum supervised learning as a thermodynamic cooling process. Building on this…

Quantum Physics · Physics 2025-01-07 Nayeli A. Rodríguez-Briones , Daniel K. Park

Adaptive systems -- such as a biological organism gaining survival advantage, an autonomous robot executing a functional task, or a motor protein transporting intracellular nutrients -- must model the regularities and stochasticity in their…

Statistical Mechanics · Physics 2021-04-13 A. B. Boyd , J. P. Crutchfield , M. Gu

We introduce a machine-learning density-functional-theory formalism for the spinless Hubbard model in one dimension at both zero and finite temperature. In the zero-temperature case this establishes a one-to-one relation between the site…

Strongly Correlated Electrons · Physics 2021-06-16 James Nelson , Rajarshi Tiwari , Stefano Sanvito

Based on deep neural networks (DNNs), deep learning has been successfully applied to many problems, but its mechanism is still not well understood -- especially the reason why over-parametrized DNNs can generalize. A recent statistical…

Disordered Systems and Neural Networks · Physics 2025-06-10 Gang Huang , Lai Shun Chan , Hajime Yoshino , Ge Zhang , Yuliang Jin

As powerful as machine learning (ML) techniques are in solving problems involving data with large dimensionality, explaining the results from the fitted parameters remains a challenging task of utmost importance, especially in physics…

Disordered Systems and Neural Networks · Physics 2024-04-15 Roberto C. Alamino

Beyond neural scaling laws, little is known about the laws underlying large language models (LLMs). We introduce Neural Thermodynamic Laws (NTL) -- a new framework that offers fresh insights into LLM training dynamics. On the theoretical…

Machine Learning · Computer Science 2025-05-16 Ziming Liu , Yizhou Liu , Jeff Gore , Max Tegmark

In this review the debated rapport between thermodynamics and quantum mechanics is addressed in the framework of the theory of periodically-driven/controlled quantum-thermodynamic machines. The basic model studied here is that of a…

Quantum Physics · Physics 2015-09-15 D. Gelbwaser-Klimovsky , Wolfgang Niedenzu , Gershon Kurizki

A Boltzmann machine is a stochastic neural network that has been extensively used in the layers of deep architectures for modern machine learning applications. In this paper, we develop a Boltzmann machine that is capable of modelling…

Statistical Mechanics · Physics 2016-10-18 Giacomo Torlai , Roger G. Melko

Thermal errors in machine tools significantly impact machining precision and productivity. Traditional thermal error correction/compensation methods rely on measured temperature-deformation fields or on transfer functions. Most existing…

Machine Learning · Computer Science 2025-10-07 C. Coelho , M. Hohmann , D. Fernández , L. Penter , S. Ihlenfeldt , O. Niggemann

In many real-world deployments of machine learning systems, data arrive piecemeal. These learning scenarios may be passive, where data arrive incrementally due to structural properties of the problem (e.g., daily financial data) or active,…

Machine Learning · Computer Science 2021-01-01 Jordan T. Ash , Ryan P. Adams

Thermodynamic phase transitions, a central concept in physics and chemistry, are typically controlled by an interplay of enthalpic and entropic contributions. In most cases, the estimation of the enthalpy in simulations is straightforward…

Soft Condensed Matter · Physics 2025-10-30 Yamin Ben-Shimon , Barak Hirshberg , Yohai Bar-Sinai

The recent technological advances in digitalization have revolutionized the industrial sector. Leveraging data analytics has now enabled the collection of deep insights into the performance and, as a result, the optimization of assets.…

Machine Learning · Computer Science 2025-04-25 Dinan Li , Panagiotis Kakosimos , Luca Peretti

We develop a physics-based model for classical computation based on autonomous quantum thermal machines. These machines consist of few interacting quantum bits (qubits) connected to several environments at different temperatures. Heat flows…

Quantum Physics · Physics 2025-03-06 Patryk Lipka-Bartosik , Martí Perarnau-Llobet , Nicolas Brunner
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