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In this paper, we focus on the nonconvex-nonconvex bilevel optimization problem (BLO), where both upper-level and lower-level objectives are nonconvex, with the upper-level problem potentially being nonsmooth. We develop a two-timescale…

Optimization and Control · Mathematics 2026-04-24 Nachuan Xiao , Xiaoyin Hu , Xin Liu , Kim-Chuan Toh

We propose a path optimization method (POM) to evade the sign problem in the Monte-Carlo calculations for complex actions. Among many approaches to the sign problem, the Lefschetz-thimble path-integral method and the complex Langevin method…

High Energy Physics - Lattice · Physics 2019-11-05 Akira Ohnishi , Yuto Mori , Kouji Kashiwa

The concept of Lefschetz thimble decomposition is one of the most promising possible modifications of Quantum Monte Carlo (QMC) algorithms aimed at alleviating the sign problem which appears in many interesting physical situations, e.g. in…

Strongly Correlated Electrons · Physics 2017-12-07 M. V. Ulybyshev , S. N. Valgushev

We introduce a powerful Monte Carlo (MC) algorithm for the atomistic simulation of bulk models of oligo- and poly-thiophenes by redesigning MC moves originally developed for considerably simpler polymer structures and architectures, such as…

Soft Condensed Matter · Physics 2019-03-06 Flora D. Tsourtou , Stavros D. Peroukidis , Loukas D. Peristeras , Vlasis G. Mavrantzas

The multilevel blocking algorithm recently proposed as a possible solution to the sign problem in path-integral Monte Carlo simulations has been extended to systems with long-ranged interactions along the Trotter direction. As an…

Chemical Physics · Physics 2009-11-06 R. Egger , L. Muehlbacher , C. H. Mak

The complexification of field variables is an elegant approach to attack the sign problem. In one approach one integrates on Lefschetz thimbles: over them, the imaginary part of the action stays constant and can be factored out of the…

High Energy Physics - Lattice · Physics 2020-01-10 Kevin Zambello , Francesco Di Renzo

We point out that Monte Carlo simulations of theories with severe sign problems can be profitably performed over manifolds in complex space different from the one with fixed imaginary part of the action. We describe a family of such…

High Energy Physics - Lattice · Physics 2016-03-22 Andrei Alexandru , Gokce Basar , Paulo F. Bedaque , Gregory W. Ridgway , Neill C. Warrington

We introduce an algorithm for treating growth on surfaces which combines important features of continuum methods (such as the level-set method) and Kinetic Monte Carlo (KMC) simulations. We treat the motion of adatoms in continuum theory,…

Materials Science · Physics 2009-11-10 G. Russo , L. M. Sander , P. Smereka

Lefschetz thimbles have been proposed recently as a possible solution to the complex action problem (sign problem) in Monte Carlo simulations. Here we discuss pure abelian gauge theory with a complex coupling $\beta$ and apply the concept…

High Energy Physics - Lattice · Physics 2020-01-28 Jan M. Pawlowski , Manuel Scherzer , Christian Schmidt , Felix P. G. Ziegler , Felix Ziesché

The Hybrid Monte Carlo (HMC) algorithm currently is the favorite scheme to simulate quantum chromodynamics including dynamical fermions. In this talk-which is intended for a non-expert audience--I want to bring together methodical and…

High Energy Physics - Lattice · Physics 2009-10-30 Thomas Lippert

The Direct Simulation Monte Carlo (DSMC) method is widely employed for simulating rarefied nonequilibrium gas flows. With advances in aerospace engineering and micro/nano-scale technologies, gas flows exhibit the coexistence of rarefied and…

Computational Physics · Physics 2025-07-01 Hao Jin , Sha Liu , Sirui Yang , Junzhe Cao , Congshan Zhuo , Chengwen Zhong

Complex Langevin (CL) is a computational method to circumvent the numerical sign problem with applications in finite-density quantum chromodynamics and the real-time dynamics of quantum field theories. It has long been known that, depending…

High Energy Physics - Lattice · Physics 2025-03-24 Kirill Boguslavski , Paul Hotzy , David I. Müller

It was recently demonstrated that a simple Monte Carlo (MC) algorithm involving the swap of particle pairs dramatically accelerates the equilibrium sampling of simulated supercooled liquids. We propose two numerical schemes integrating the…

Statistical Mechanics · Physics 2019-06-24 Ludovic Berthier , Elijah Flenner , Christopher J. Fullerton , Camille Scalliet , Murari Singh

We study the heavy-dense limit of QCD on the lattice with heavy quarks at high density. The effective three dimensional theory has a sign problem which is alleviated by sign optimization where the path integration domain is deformed in…

High Energy Physics - Theory · Physics 2023-12-14 Gokce Basar , Joseph Marincel

We present the first practical Monte Carlo calculations of the recently proposed Lefschetz thimble formulation of quantum field theories. Our results provide strong evidence that the numerical sign problem that afflicts Monte Carlo…

High Energy Physics - Lattice · Physics 2013-11-15 Marco Cristoforetti , Francesco Di Renzo , Abhishek Mukherjee , Luigi Scorzato

One of the open challenges in quantum computing is to find meaningful and practical methods to leverage quantum computation to accelerate classical machine learning workflows. A ubiquitous problem in machine learning workflows is sampling…

Quantum Physics · Physics 2024-08-08 Owen Lockwood , Peter Weiss , Filip Aronshtein , Guillaume Verdon

A solution to the sign problem is the so-called "Lefschetz thimble approach" where the domain of integration for field variables in the path integral is deformed from the real axis to a sub-manifold in the complex space. For properly chosen…

High Energy Physics - Lattice · Physics 2016-06-01 Andrei Alexandru , Gokce Basar , Paulo F. Bedaque , Gregory W. Ridgway , Neill C. Warrington

We investigate the performance of the hybrid Monte Carlo algorithm in updating non-trivial global topological structures. We find that the hybrid Monte Carlo algorithm has serious problems decorrelating the global topological charge. This…

High Energy Physics - Lattice · Physics 2016-08-15 G. Boyd , B. Allés , M. D'Elia , A. Di Giacomo , E. Vicari

We present a new approach to path integral Monte Carlo (PIMC) simulations based on the worm algorithm, originally developed for lattice models and extended here to continuous-space many-body systems. The scheme allows for efficient…

Statistical Mechanics · Physics 2009-11-11 M. Boninsegni , N. Prokof'ev , B. Svistunov

We apply the Worldvolume Hybrid Monte Carlo (WV-HMC) method [arXiv:2012.08468] to the two-dimensional Hubbard model, which is known to suffer from a severe sign problem when the system is doped (away from half filling). We show that the…

High Energy Physics - Lattice · Physics 2026-05-15 Masafumi Fukuma , Yusuke Namekawa