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An efficient scheme is introduced for a fast and smooth convergence to the thermodynamic limit with finite size cluster calculations. This is obtained by modifying the energy levels of the non interacting Hamiltonian in a way consistent…

强关联电子 · 物理学 2015-05-12 Sandro Sorella

Monte Carlo integration is a commonly used technique to compute intractable integrals and is typically thought to perform poorly for very high-dimensional integrals. To show that this is not always the case, we examine Monte Carlo…

统计方法学 · 统计学 2023-05-26 Yanbo Tang

Convergence diagnosis for Markov chain Monte Carlo is a matter of fundamental importance in computational statistics: it determines the resources allocated to a particular sampling problem and influences the practitioner's view of the…

统计计算 · 统计学 2026-05-14 Buu Phan , Gergely Flamich , Ashish Khisti , Shahab Asoodeh

In a recent paper we have introduced several possible inequivalent descriptions of the dynamics and of the transition probabilities of a quantum system when its Hamiltonian is not self-adjoint. Our analysis was carried out in finite…

数学物理 · 物理学 2015-08-12 Fabio Bagarello

Non-hermitian, $\mathcal{PT}$-symmetric Hamiltonians, experimentally realized in optical systems, accurately model the properties of open, bosonic systems with balanced, spatially separated gain and loss. We present a family of exactly…

量子物理 · 物理学 2015-12-17 Kaustubh S. Agarwal , Rajeev K. Pathak , Yogesh N. Joglekar

High-quality random samples of quantum states are needed for a variety of tasks in quantum information and quantum computation. Searching the high-dimensional quantum state space for a global maximum of an objective function with many local…

量子物理 · 物理学 2015-04-28 Yi-Lin Seah , Jiangwei Shang , Hui Khoon Ng , David John Nott , Berthold-Georg Englert

The diagramatic Monte Carlo method has so far been primarily used in connection with the weak coupling expansion. Here we show that the strong coupling expansion offers a significant advantage: it can be efficiently implemented on both the…

强关联电子 · 物理学 2023-11-17 Kristjan Haule

For big data analysis, high computational cost for Bayesian methods often limits their applications in practice. In recent years, there have been many attempts to improve computational efficiency of Bayesian inference. Here we propose an…

统计计算 · 统计学 2017-04-19 Cheng Zhang , Babak Shahbaba , Hongkai Zhao

This paper discusses the irreducibility and geometric ergodicity of the Hamiltonian Monte Carlo (HMC) algorithm. We consider cases where the number of steps of the symplectic integrator is either fixed or random. Under mild conditions on…

统计计算 · 统计学 2019-05-14 Alain Durmus , Eric Moulines , Eero Saksman

In Bayesian inference, Hamiltonian Monte Carlo (HMC) is a popular Markov Chain Monte Carlo (MCMC) algorithm known for its efficiency in sampling from complex probability distributions. However, its application to models with latent…

统计计算 · 统计学 2025-04-15 Alaa Amri , Víctor Elvira , Amy L. Wilson

Probabilistic programming uses programs to express generative models whose posterior probability is then computed by built-in inference engines. A challenging goal is to develop general purpose inference algorithms that work out-of-the-box…

机器学习 · 计算机科学 2022-11-03 Carol Mak , Fabian Zaiser , Luke Ong

The Hamiltonian Monte Carlo (HMC) algorithm is a powerful Markov Chain Monte Carlo (MCMC) method that uses Hamiltonian dynamics to generate samples from a target distribution. To fully exploit its potential, we must understand how…

统计计算 · 统计学 2025-01-27 Abraham Granados , Isaías Bañales

Hamiltonian Monte Carlo (HMC) samples efficiently from high-dimensional posterior distributions with proposed parameter draws obtained by iterating on a discretized version of the Hamiltonian dynamics. The iterations make HMC…

统计计算 · 统计学 2019-05-03 Khue-Dung Dang , Matias Quiroz , Robert Kohn , Minh-Ngoc Tran , Mattias Villani

Hamiltonian Monte Carlo (HMC) is an efficient Bayesian sampling method that can make distant proposals in the parameter space by simulating a Hamiltonian dynamical system. Despite its popularity in machine learning and data science, HMC is…

机器学习 · 统计学 2020-09-02 Ziming Liu , Zheng Zhang

Riemannian manifold Hamiltonian Monte Carlo (RMHMC) is a sampling algorithm that seeks to adapt proposals to the local geometry of the posterior distribution. The specific form of the Hamiltonian used in RMHMC necessitates {\it…

统计计算 · 统计学 2021-11-22 James A. Brofos , Roy R. Lederman

The Hamiltonian Monte Carlo method generates samples by introducing a mechanical system that explores the target density. For distributions on manifolds it is not always simple to perform the mechanics as a result of the lack of global…

统计计算 · 统计学 2019-04-22 Alessandro Barp , Anthony Kennedy , Mark Girolami

We unify slice sampling and Hamiltonian Monte Carlo (HMC) sampling, demonstrating their connection via the Hamiltonian-Jacobi equation from Hamiltonian mechanics. This insight enables extension of HMC and slice sampling to a broader family…

机器学习 · 统计学 2018-01-12 Yizhe Zhang , Xiangyu Wang , Changyou Chen , Ricardo Henao , Kai Fan , Lawrence Carin

We provide a general methodology for unbiased estimation for intractable stochastic models. We consider situations where the target distribution can be written as an appropriate limit of distributions, and where conventional approaches…

统计方法学 · 统计学 2014-12-01 Sergios Agapiou , Gareth O. Roberts , Sebastian J. Vollmer

Although Hamiltonian Monte Carlo (HMC) scales as O(d^(1/4)) in dimension, there is a large constant factor determined by the curvature of the target density. This constant factor can be reduced in most cases through preconditioning, the…

统计计算 · 统计学 2026-03-20 Adrian Seyboldt , Eliot L. Carlson , Bob Carpenter

The goal of this article is to introduce the Hamiltonian Monte Carlo (HMC) method -- a Hamiltonian dynamics-inspired algorithm for sampling from a Gibbs density $\pi(x) \propto e^{-f(x)}$. We focus on the "idealized" case, where one can…

数据结构与算法 · 计算机科学 2021-08-30 Nisheeth K. Vishnoi