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In this study, we introduce a novel approach to coupled-cluster Green's function (CCGF) embedding by seamlessly integrating conventional CCGF theory with the state-of-the-art sub-system embedding sub-algebras coupled cluster (SES-CC)…

Quantum Physics · Physics 2023-12-21 Bo Peng , Karol Kowalski

We present a numerical study of the application of the Shannon entropy technique to the planar restricted three-body problem in the vicinity of first-order interior mean-motion resonances with the perturber. We estimate the diffusion…

Chaotic Dynamics · Physics 2020-01-08 C. Beaugé , P. M. Cincotta

We present an overview of electronic device modeling using non-equilibrium Green function techniques. The basic approach developed in the early 1970s has become increasingly popular during the last 10 years. The rise in popularity was…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Roger K. Lake , Rajeev R. Pandey

Simulations of finite temperature quantum systems provide imaginary frequency Green's functions that correspond one-to-one to experimentally measurable real-frequency spectral functions. However, due to the bad conditioning of the…

Strongly Correlated Electrons · Physics 2021-02-10 Jiani Fei , Chia-Nan Yeh , Emanuel Gull

We consider a differential method of maximum entropy that is based on the linearity of Fourier transform and involves reconstruction of images from the differences of the visibility function. The efficiency of the method is demonstrated…

Astrophysics · Physics 2015-06-24 Anisa T. Bajkova

This paper addresses the estimation of parameters of a Bayesian network from incomplete data. The task is usually tackled by running the Expectation-Maximization (EM) algorithm several times in order to obtain a high log-likelihood…

Machine Learning · Computer Science 2015-03-19 Giorgio Corani , Cassio P. De Campos

This article addresses the issue of the proof of the entropy power inequality (EPI), an important tool in the analysis of Gaussian channels of information transmission, proposed by Shannon. We analyse continuity properties of the mutual…

Information Theory · Computer Science 2013-04-04 Mark Kelbert , Yuri Suhov

We introduce Shannon's information entropy to characterize the avoided crossing appearing in the resonant Zener-like phenomenon in ultrasonic superlattices made of two different fluidlike meta- materials. We show that Shannon's entropy…

Other Condensed Matter · Physics 2009-11-13 Helios Sanchis-Alepuz , Jose Sanchez-Dehesa

Herein we study the problem of recovering a density operator from a set of compatible marginals, motivated from limitations of physical observations. Given that the set of compatible density operators is not singular, we adopt Jaynes'…

Mathematical Physics · Physics 2021-01-21 Serena Di Giorgio , Paulo Mateus

This paper presents a structure-preserving Bayesian approach for learning nonseparable Hamiltonian systems using stochastic dynamic models allowing for statistically-dependent, vector-valued additive and multiplicative measurement noise.…

Machine Learning · Statistics 2024-07-23 Nicholas Galioto , Harsh Sharma , Boris Kramer , Alex Arkady Gorodetsky

In this simple article, with possible applications in theoretical and applied physics, we suggest an original way to derive the expression of Shannon's entropy from a purely variational approach,using constraints. Based on the work of Edwin…

Statistical Mechanics · Physics 2021-07-13 Thomas Cailleteau

We propose a Bayesian nonparametric mixture model for the reconstruction and prediction from observed time series data, of discretized stochastic dynamical systems, based on Markov Chain Monte Carlo methods (MCMC). Our results can be used…

Applications · Statistics 2017-10-03 Christos Merkatas , Konstantinos Kaloudis , Spyridon J. Hatjispyros

Including finite-temperature effects from the electronic degrees of freedom in electronic structure calculations of semiconductors and metals is desired; however, in practice it remains exceedingly difficult when using zero-temperature…

Chemical Physics · Physics 2016-11-24 Alicia Rae Welden , Alexander A. Rusakov , Dominika Zgid

Bayesian neural networks (BNNs) augment deep networks with uncertainty quantification by Bayesian treatment of the network weights. However, such models face the challenge of Bayesian inference in a high-dimensional and usually…

Machine Learning · Computer Science 2021-03-30 Zhijie Deng , Yucen Luo , Jun Zhu , Bo Zhang

Bayesian statistics in the frame of the maximum entropy concept has widely been used for inferential problems, particularly, to infer dynamic properties of strongly correlated fermion systems from Quantum-Monte-Carlo (QMC) imaginary time…

Condensed Matter · Physics 2016-08-31 W. von der Linden , R. Preuss , W. Hanke

We study a quantity called discrete layered entropy, which approximates the Shannon entropy within a logarithmic gap. Compared to the Shannon entropy, the discrete layered entropy is piecewise linear, approximates the expected length of the…

Information Theory · Computer Science 2026-01-27 Cheuk Ting Li

In this paper, we study the trade-offs of different inference approaches for Bayesian matrix factorisation methods, which are commonly used for predicting missing values, and for finding patterns in the data. In particular, we consider…

Machine Learning · Statistics 2017-07-18 Thomas Brouwer , Jes Frellsen , Pietro Lió

We present an efficient implementation of a surface Green's-function method for atomistic modeling of surfaces within the framework of density functional theory using a pseudopotential localized basis set approach. In this method, the…

We put forward a new Bayesian modeling strategy for spatiotemporal count data that enables efficient posterior sampling. Most previous models for such data decompose logarithms of the response Poisson rates into fixed effects and spatial…

Methodology · Statistics 2025-07-29 Yifan Cheng , Cheng Li

We report multipronged progress on the stochastic averaging approach to numerical analytic continuation of quantum Monte Carlo data. With the sampled spectrum parametrized with delta-functions in continuous frequency space, a calculation of…

Strongly Correlated Electrons · Physics 2023-01-11 Hui Shao , Anders W. Sandvik