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Leveraging matrix sparsity has proven a fruitful strategy for accelerating quantum chemical calculations. Here we present the hierarchical SOS-MP2 algorithm, which uses hierarchical matrix ($\mathcal{H}^{2}$) compression of the electron…

化学物理 · 物理学 2025-06-23 Hongji Gao , Xiangmin Jiao , Benjamin G. Levine

We use the quantum kinetic theory to calculate the steady state and the fluctuations of a trapped Bose-Einstein condensate at finite temperature. The system is divided in a condensate and a non-condensate part. A quantum mechanical…

统计力学 · 物理学 2009-10-30 D. Jaksch , C. W. Gardiner , K. M. Gheri , P. Zoller

Dimension reduction is widely regarded as an effective way for decreasing the computation, storage and communication loads of data-driven intelligent systems, leading to a growing demand for statistical methods that allow analysis (e.g.,…

计算机视觉与模式识别 · 计算机科学 2019-08-23 Guangcan Liu , Zhao Zhang , Qingshan Liu , Kongkai Xiong

The classical Ka\v{c}anov scheme for the solution of nonlinear variational problems can be interpreted as a fixed point iteration method that updates a given approximation by solving a linear problem in each step. Based on this observation,…

数值分析 · 数学 2021-11-30 Pascal Heid , Thomas P. Wihler

Characterizing the entropy of a system is a crucial, and often computationally costly, step in understanding its thermodynamics. It plays a key role in the study of phase transitions, pattern formation, protein folding and more. Current…

统计力学 · 物理学 2020-12-02 Amit Nir , Eran Sela , Roy Beck , Yohai Bar-Sinai

In scientific simulations, observations, and experiments, the cost of transferring data to and from disk and across networks has become a significant bottleneck that particularly impacts subsequent data analysis and visualization. To…

数据库 · 计算机科学 2023-08-24 Victor A. P. Magri , Peter Lindstrom

This article extends the concept of compressed sensing to signals that are not sparse in an orthonormal basis but rather in a redundant dictionary. It is shown that a matrix, which is a composition of a random matrix of certain type and a…

概率论 · 数学 2010-11-10 Holger Rauhut , Karin Schnass , Pierre Vandergheynst

It is often stated that if one is presented with a snapshot of the positions of the molecules of a glass and one of a liquid, one is unable to tell the difference. Here we argue instead that given several such snapshots taken over a…

无序系统与神经网络 · 物理学 2024-02-08 Ittai Fraenkel , Jorge Kurchan , Dov Levine

To deploy machine learning models on-device, practitioners use compression algorithms to shrink and speed up models while maintaining their high-quality output. A critical aspect of compression in practice is model comparison, including…

人机交互 · 计算机科学 2025-01-27 Angie Boggust , Venkatesh Sivaraman , Yannick Assogba , Donghao Ren , Dominik Moritz , Fred Hohman

Interacting random field of probabilities links Kolmogorov law 0-1 and Bayesian probabilities observing Markov diffusion process under Yes-No actions of random impulse. These objective probabilities measure virtual probing impulses…

适应与自组织系统 · 物理学 2017-09-08 Vladimir S. Lerner

We propose a novel numerical approach for nonlocal diffusion equations [8] with integrable kernels, based on the relationship between the backward Kolmogorov equation and backward stochastic differential equations (BSDEs) driven by L\`{e}vy…

数值分析 · 数学 2015-07-28 Guannan Zhang , Weidong Zhao , Clayton Webster , Max Gunzburger

Anomalous diffusion is a common phenomenon observed in underground solute transport, soil water infiltration and sediment movement, etc. Time and space fractional derivative advection-dispersion equation (FADE) has been widely employed as…

数值分析 · 数学 2017-06-07 HongGuang Sun , Xiaoting Liu , Yong Zhang , Guofei Pang , Rhiannon Garrard

Resolving numerically Vlasov-Poisson equations for initially cold systems can be reduced to following the evolution of a three-dimensional sheet evolving in six-dimensional phase-space. We describe a public parallel numerical algorithm…

计算物理 · 物理学 2016-06-29 Thierry Sousbie , Stéphane Colombi

We investigate the role of a statistical complexity measure to assign equilibration in isolated quantum systems. While unitary dynamics preserve global purity, expectation values of observables often exhibit equilibration-like behavior,…

量子物理 · 物理学 2025-08-14 Marcos G. Alpino , Tiago Debarba , Reinaldo O. Vianna , André T. Cesário

We introduce the Tensorized-and-Restricted Krylov (TReK) method, a simple and efficient algorithm for estimating covariance tensors with large observational sizes. TReK extends the conjugate gradient method to incorporate range…

统计计算 · 统计学 2025-09-03 Ho Yun , Victor M. Panaretos

While several numerical techniques are available for predicting the dynamics of non-Markovian open quantum systems, most struggle with simulations for very long memory and propagation times, e.g., due to superlinear scaling with the number…

量子物理 · 物理学 2025-05-01 Moritz Cygorek , Jonathan Keeling , Brendon W. Lovett , Erik M. Gauger

Dissipative Particle Dynamics (DPD) is a popular simulation model for investigating hydrodynamic behavior of systems with non-negligible equilibrium thermal fluctuations. DPD employs soft core repulsive interactions between the system…

统计力学 · 物理学 2016-03-23 Oded Farago , Niels Grønbech-Jensen

Compressive sensing is a novel approach that linearly samples sparse or compressible signals at a rate much below the Nyquist-Shannon sampling rate and outperforms traditional signal processing techniques in acquiring and reconstructing…

信息论 · 计算机科学 2019-01-03 Ramin Ayanzadeh , Seyedahmad Mousavi , Milton Halem , Tim Finin

The aim of this paper is to shed light on the analysis of non-stationary time series by means of the method of diffusion entropy. For this purpose, we first study the case when infinitely many time series, as different realizations of the…

统计力学 · 物理学 2007-05-23 M. Virgilio , P. Grigolini

In this paper, we present a novel method for co-clustering, an unsupervised learning approach that aims at discovering homogeneous groups of data instances and features by grouping them simultaneously. The proposed method uses the entropy…

机器学习 · 统计学 2017-05-22 Charlotte Laclau , Ievgen Redko , Basarab Matei , Younès Bennani , Vincent Brault
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