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Density functional theory (DFT) serves as the basis for computational discovery in materials science and chemistry, yet each calculation demands extensive human effort: adjusting algorithms when convergence stalls, revising plans when…

Materials Science · Physics 2026-05-27 Penghui Yang , Zhonghan Zhang , Yue Li , Xinrun Wag , Yanchen Deng , Yuhao Lu , Bijun Tang , Zheng Liu , Bo An

Companion paper [118] developed a powerful \emph{Random duality theory} (RDT) based analytical program to statistically characterize performance of \emph{descending} phase retrieval algorithms (dPR) (these include all variants of gradient…

Machine Learning · Statistics 2025-06-24 Mihailo Stojnic

Trawl processes belong to the class of continuous-time, strictly stationary, infinitely divisible processes; they are defined as Levy bases evaluated over deterministic trawl sets. This article presents the first nonparametric estimator of…

Statistics Theory · Mathematics 2026-02-17 Orimar Sauri , Almut E. D. Veraart

Distributionally robust reinforcement learning (DRRL) focuses on designing policies that achieve good performance under model uncertainties. The goal is to maximize the worst-case long-term discounted reward, where the data for RL comes…

Machine Learning · Computer Science 2026-03-17 Saptarshi Mandal , Yashaswini Murthy , R. Srikant

In this work we study the rate-distortion function (RDF) for lossy compression of asynchronously-sampled continuous-time (CT) wide-sense cyclostationary (WSCS) Gaussian processes with memory. As the case of synchronous sampling, i.e., when…

Information Theory · Computer Science 2024-05-27 Zikun Tan , Ron Dabora , H. Vincent Poor

Aligning generative diffusion models with human preferences via reinforcement learning (RL) is critical yet challenging. Most existing algorithms are often vulnerable to reward hacking, such as quality degradation, over-stylization, or…

We numerically investigate dynamical property in the one-dimensional tight-binding model with long-range correlated disorder having power spectrum $1/f^\alpha$ ($\alpha:$spectrum exponent) generated by Fourier filtering method. For…

Disordered Systems and Neural Networks · Physics 2017-12-22 Hiroaki S. Yamada

We present a differentiation framework for plane-wave density-functional theory (DFT) that combines the strengths of forward-mode algorithmic differentiation (AD) and density-functional perturbation theory (DFPT). In the resulting AD-DFPT…

Materials Science · Physics 2025-12-23 Niklas Frederik Schmitz , Bruno Ploumhans , Michael F. Herbst

Many mathematical, man-made and natural systems exhibit a leading-digit bias, where a first digit (base 10) of 1 occurs not 11\% of the time, as one would expect if all digits were equally likely, but rather 30\%. This phenomenon is known…

We obtain asymptotic bounds for the tail distribution of steady-state waiting time in a two server queue where each server processes incoming jobs at a rate equal to the rate of their arrivals (that is, the half-loaded regime). The job…

Probability · Mathematics 2016-04-05 Jose Blanchet , Karthyek Murthy

Many real time-series exhibit behavior adequate to long range dependent data. Additionally very often these time-series have constant time periods and also have characteristics similar to Gaussian processes although they are not Gaussian.…

Data Analysis, Statistics and Probability · Physics 2017-01-04 A. Kumar , A. Wyłomańska , R. Połoczański , S. Sundar

We consider a Markov modulated fluid network with a finite number of stations. We are interested in the tail asymptotics behavior of the stationary distribution of its buffer content process. Using two different approaches, we derive upper…

Probability · Mathematics 2020-09-29 Masakiyo Miyazawa

We consider random variables observed at arrival times of a renewal process, which possibly depends on those observations and has regularly varying steps with infinite mean. Due to the dependence and heavy tailed steps, the limiting…

Probability · Mathematics 2016-08-08 Bojan Basrak , Drago Špoljarić

In the context of communication networks, the framework of stochastic event graphs allows a modeling of control mechanisms induced by the communication protocol and an analysis of its performances. We concentrate on the logarithmic tail…

Probability · Mathematics 2007-05-23 Marc Lelarge

Strong anomalous diffusion is characterized by asymptotic power-law growth of the moments of displacement, with exponents that do not depend linearly on the order of the moment. The exponents concerning small-order moments are dominated by…

Statistical Mechanics · Physics 2021-01-27 Jürgen Vollmer , Lamberto Rondoni , Muhammad Tayyab , Claudio Giberti , Carlos Mejía-Monasterio

In this article we use a covariance function that arises from limit of fluctuations of the rescaled occupation time process of a branching particle system, to introduce a family of weighted long-range dependence Gaussian processes. In…

Probability · Mathematics 2025-10-14 Jose Hermenegildo Ramirez Gonzalez , Antonio Murillo Salas , Ying Sun

Motivated by studies on the recurrent properties of animal and human mobility, we introduce a path-dependent random walk model with long range memory for which not only the mean square displacement (MSD) can be obtained exactly in the…

Statistical Mechanics · Physics 2015-06-19 D. Boyer , J. C. R. Romo-Cruz

Parallel decoding for diffusion LLMs (dLLMs) is difficult because each denoising step provides only token-wise marginal distributions, while unmasking multiple tokens simultaneously requires accounting for inter-token dependencies. We…

Machine Learning · Computer Science 2026-03-16 Bumjun Kim , Dongjae Jeon , Moongyu Jeon , Albert No

We consider the drift and diffusion properties of periodically driven renewal processes. These processes are defined by a periodically time dependent waiting time distribution, which governs the interval between subsequent events. We show…

Statistical Mechanics · Physics 2009-11-11 Tobias Prager , Lutz Schimansky-Geier

Existing asynchronous distributed optimization algorithms often use diminishing step-sizes that cause slow practical convergence, or use fixed step-sizes that depend on and decrease with an upper bound of the delays. Not only are such delay…

Optimization and Control · Mathematics 2024-11-08 Xuyang Wu , Changxin Liu , Sindri Magnusson , Mikael Johansson
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