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We derive a method to efficiently compute the Green function of on arbitrary Hamiltonians defined on semi-infinite and periodic quasi-one-dimensional lattices. Computing the Green function is the backbone of quantum transport, electronic…

Mesoscale and Nanoscale Physics · Physics 2021-05-18 Pablo San-Jose

In this paper, we develop a Monte Carlo algorithm named the Frozen Gaussian Sampling (FGS) to solve the semiclassical Schr\"odinger equation based on the frozen Gaussian approximation. Due to the highly oscillatory structure of the wave…

Numerical Analysis · Mathematics 2021-12-21 Yantong Xie , Zhennan Zhou

We study the lattice Green's function (LGF) of the screened Poisson equation on a two-dimensional rectangular lattice. This LGF arises in numerical analysis, random walks, solid-state physics, and other fields. Its defining characteristic…

Numerical Analysis · Mathematics 2024-03-06 Wei Hou , Tim Colonius

This paper introduces a new stochastic optimization method based on the regularized Fisher information matrix (FIM), named SOFIM, which can efficiently utilize the FIM to approximate the Hessian matrix for finding Newton's gradient update…

Machine Learning · Computer Science 2024-05-02 Mrinmay Sen , A. K. Qin , Gayathri C , Raghu Kishore N , Yen-Wei Chen , Balasubramanian Raman

Gradient-based Monte Carlo sampling algorithms, like Langevin dynamics and Hamiltonian Monte Carlo, are important methods for Bayesian inference. In large-scale settings, full-gradients are not affordable and thus stochastic gradients…

Machine Learning · Computer Science 2019-06-25 Zhize Li , Tianyi Zhang , Shuyu Cheng , Jun Zhu , Jian Li

A diffusion Monte Carlo algorithm is introduced that can determine the correct nodal structure of the wave function of a few-fermion system and its ground-state energy without an uncontrolled bias. This is achieved by confining signed…

Computational Physics · Physics 2020-02-05 Alexander A. Kunitsa , So Hirata

We present a new method for extracting numerically exact imaginary-time Green functions from standard Hirsch-Fye quantum Monte Carlo (HF-QMC) simulations within dynamical mean-field theory. By analytic continuation, angular resolved spectra…

Strongly Correlated Electrons · Physics 2007-12-11 N. Blümer

A quantum Monte Carlo method with non-local update scheme is presented. The method is based on a path-integral decomposition and a worm operator which is local in imaginary time. It generates states with a fixed number of particles and…

Statistical Mechanics · Physics 2009-11-11 Kris Van Houcke , Stefan Rombouts , Lode Pollet

We present a highly efficient and accurate hybrid stochastic simulation algorithm (HSSA) for the purpose of simulating a subset of biochemical reactions of large gene regulatory networks (GRN). The algorithm relies on the separability of a…

Molecular Networks · Quantitative Biology 2020-09-29 Jaroslav Albert

We describe a version of an algorithm for evolving self-gravitating collections of particles that should be nearly ideal for parallel architectures. Our method is derived from the ``self-consistent field'' (SCF) approach suggested…

Astrophysics · Physics 2016-08-30 Lars Hernquist , Steinn Sigurdsson , Greg L. Bryan

Lattice gauge theories coupled to fermionic matter account for many interesting phenomena in both high energy physics and condensed matter physics. Certain regimes, e.g. at finite fermion density, are difficult to simulate with traditional…

High Energy Physics - Lattice · Physics 2023-11-16 Julian Bender , Patrick Emonts , J. Ignacio Cirac

We introduce a new class of quantum Monte Carlo methods, based on a Gaussian quantum operator representation of fermionic states. The methods enable first-principles dynamical or equilibrium calculations in many-body Fermi systems, and,…

Quantum Physics · Physics 2009-11-10 J. F. Corney , P. D. Drummond

We used methods of Bayesian statistical inference and the principle of maximum entropy to analytically continue imaginary-time Green's function generated in quantum Monte Carlo simulations to obtain the real-time Green's functions. For test…

Condensed Matter · Physics 2009-10-28 J. Bonca , J. E. Gubernatis

We discuss the Hamiltonian formulation of the Schwinger proper-time method of calculating Green functions in gauge theories. Instead of calculating Feynman diagrams, we solve the corresponding Dyson-Schwinger equations. We express the…

High Energy Physics - Phenomenology · Physics 2011-07-19 George Siopsis

Stochastic gradient method (SGM) has been popularly applied to solve optimization problems with objective that is stochastic or an average of many functions. Most existing works on SGMs assume that the underlying problem is unconstrained or…

Optimization and Control · Mathematics 2019-06-19 Yangyang Xu

We introduce a new Monte Carlo method for pure gauge theories. It is not intended for use with dynamical fermions. It belongs to the class of Local Hybrid Monte Carlo (LHMC) algorithms, which make use of the locality of the action by…

High Energy Physics - Lattice · Physics 2009-10-22 A. D. Kennedy , K. M. Bitar

In the graph-based semi-supervised learning, the Green-function method is a classical method that works by computing the Green's function in the graph space. However, when applied to large graphs, especially those sparse ones, this method…

Machine Learning · Computer Science 2024-11-05 Feiping Nie , Yitao Song , Wei Chang , Rong Wang , Xuelong Li

The stochastic variational inference (SVI) paradigm, which combines variational inference, natural gradients, and stochastic updates, was recently proposed for large-scale data analysis in conjugate Bayesian models and demonstrated to be…

Machine Learning · Statistics 2018-02-05 Rishit Sheth , Roni Khardon

We present a new non-local updating scheme for quantum Monte Carlo simulations, which conserves particle number and other symmetries. It allows exact symmetry projection and direct evaluation of the equal-time Green's function and other…

Statistical Mechanics · Physics 2009-11-11 Stefan Rombouts , Kris Van Houcke , Lode Pollet

We consider recent progress in algorithms for generating gauge field configurations that include the dynamical effects of light fermions. We survey what has been achieved in recent state-of-the-art computations, and examine the trade-offs…

High Energy Physics - Lattice · Physics 2009-11-10 A. D. Kennedy
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