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Machine learning interatomic potentials (MLIPs) have become widely used tools in atomistic simulations. For much of the history of this field, the most commonly employed architectures were based on short-ranged atomic energy contributions,…

Chemical Physics · Physics 2026-03-17 William J. Baldwin , Ilyes Batatia , Martin Vondrák , Johannes T. Margraf , Gábor Csányi

With the continuous advancement of reasoning abilities in Large Language Models (LLMs), their application to scientific reasoning tasks has gained significant research attention. Current research primarily emphasizes boosting LLMs'…

Artificial Intelligence · Computer Science 2026-05-19 Zhaoxin Yu , Nan Xu , Kun Chen , Jiahao Zhao , Lei Wang , Wenji Mao

Logical reasoning consistently plays a fundamental and significant role in the domains of knowledge engineering and artificial intelligence. Recently, Large Language Models (LLMs) have emerged as a noteworthy innovation in natural language…

Computation and Language · Computer Science 2024-09-17 Fangzhi Xu , Qika Lin , Jiawei Han , Tianzhe Zhao , Jun Liu , Erik Cambria

The reasoning capabilities of Large Language Models (LLMs) are increasingly attributed to training data quality rather than mere parameter scaling. However, existing data-centric paradigms often equate quality with factuality or diversity…

Artificial Intelligence · Computer Science 2026-02-13 Zhen Bi , Zhenlin Hu , Xueshu Chen , Mingyang Chen , Cheng Deng , Yida Xue , Zhen Wang , Qing Shen , Ningyu Zhang , Jungang Lou

We consider some natural connections which arise between right-flat (p, q) paraconformal structures and integrable systems. We find that such systems may be formulated in Lax form, with a "Lax p-tuple" of linear differential operators,…

solv-int · Physics 2007-05-23 James D. E. Grant

We study a classical multiparticle system (such as Toda lattice) whose dynamics we intend to control by forces applied to few particles of the system. Various problem settings, typical for control theory are posed for this model; among…

Optimization and Control · Mathematics 2008-09-16 Andrey Sarychev

Large language models (LLMs) are a promising venue for natural language understanding and generation. However, current LLMs are far from reliable: they are prone to generating non-factual information and, more crucially, to contradicting…

Computation and Language · Computer Science 2024-09-24 Diego Calanzone , Stefano Teso , Antonio Vergari

In a recent one-dimensional numerical fluid simulation study [Saxena et al., Phys. Plasmas 13,032309 (2006)], it was found that an instability is associated with a special class of one-dimensional nonlinear solutions for modulated light…

Plasma Physics · Physics 2008-09-12 Vikrant Saxena , Amita Das , Sudip Sengupta , Predhiman Kaw , Abhijit Sen

The advancement of large language models (LLMs) for real-world applications hinges critically on enhancing their reasoning capabilities. In this work, we explore the reasoning abilities of large language models (LLMs) through their…

Artificial Intelligence · Computer Science 2024-07-04 Romain Cosentino , Sarath Shekkizhar

As in arXiv: math. 0809.2365 we consider classical system of interacting particles $\mathcal{P}_1, ..., \mathcal{P}_n$ on the line with only neighboring particles involved in interaction. On the contrast to arXiv: math. 0809.2365 now {\it…

Optimization and Control · Mathematics 2008-12-05 Andrey Sarychev

Large Language Models (LLMs) have shown to be capable of various tasks, yet their capability in interpreting and reasoning over tabular data remains an underexplored area. In this context, this study investigates from three core…

Computation and Language · Computer Science 2023-12-29 Tianyang Liu , Fei Wang , Muhao Chen

We are interested in developing a numerical method for capturing stationary sheaths, that a plasma forms in contact with a metallic wall. This work is based on a bi-species (ion/electron) Vlasov-Amp{\`e}re model proposed in [3]. The main…

Numerical Analysis · Mathematics 2018-02-19 Mehdi Badsi , Michel Mehrenberger , Laurent Navoret

Intuitionistic logic extended with decidable propositional atoms combines classical properties in its propositional part and intuitionistic properties for derivable formulas not containing propositional symbols. Sequent calculus is used as…

General Mathematics · Mathematics 2007-05-23 Alexander Sakharov

Solvent environments play a central role in determining molecular structure, energetics, reactivity, and interfacial phenomena. However, modeling solvation from first principles remains difficult due to the complex interplay of interactions…

Chemical Physics · Physics 2026-01-05 Roopshree Banchode , Surajit Das , Shampa Raghunathan , Raghunathan Ramakrishnan

The typical mathematical language systematically exploits notational and logical abuses whose resolution requires not just the knowledge of domain specific notation and conventions, but not trivial skills in the given mathematical…

Logic in Computer Science · Computer Science 2011-03-18 Andrea Asperti , Enrico Tassi

We review some older and more recent results concerning the energy and particle distribution in ground states of heavy Coulomb systems. The reviewed results are asymptotic in nature: they describe properties of many-particle systems in the…

Mathematical Physics · Physics 2023-02-07 Rupert L. Frank , Konstantin Merz , Heinz Siedentop

A new type of material with embedded intelligence, namely 'intelligent plasma', is introduced. Such new material exhibits programmable chemical pathway networks resembling artificial neural networks. As a Markov process of chemistry, the…

Emerging Technologies · Computer Science 2021-09-08 Li Lin , Michael Keidar

The main purpose of thispaper is to show that composite quantum-like (QL) systems can closely mimic the separable states of quantum systems, and that suitable physical systems exhibiting these states exist. It is shown that QL graphs can…

Quantum Physics · Physics 2026-03-24 Gregory D. Scholes

Multimodal Large Language Models (MLLMs) have demonstrated remarkable capabilities in diverse reasoning tasks, yet their application to complex physics reasoning remains underexplored. Physics reasoning presents unique challenges, requiring…

Computation and Language · Computer Science 2025-05-23 Song Dai , Yibo Yan , Jiamin Su , Dongfang Zihao , Yubo Gao , Yonghua Hei , Jungang Li , Junyan Zhang , Sicheng Tao , Zhuoran Gao , Xuming Hu

An approach is suggested for treating multiscale fluctuations in macromolecular systems. The emphasis is on the statistical properties of such fluctuations. The approach is illustrated by a macromolecular system with mesoscopic fluctuations…

Chemical Physics · Physics 2012-08-07 V. I. Yukalov , E. P. Yukalova