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This paper introduces a geometric multigrid preconditioner for the Shifted Boundary Method (SBM) designed to solve PDEs on complex geometries. While SBM simplifies mesh generation by using a non-conforming background grid, it often results…

Numerical Analysis · Mathematics 2026-01-01 Michal Wichrowski

Data-driven acceleration of scientific computing workflows has been a high-profile aim of machine learning (ML) for science, with numerical simulation of transient partial differential equations (PDEs) being one of the main applications.…

Computational Physics · Physics 2025-12-05 Mikhail Khodak , Min Ki Jung , Brian Wynne , Edmond Chow , Egemen Kolemen

This paper reveals that a common and central role, played in many error bound (EB) conditions and a variety of gradient-type methods, is a residual measure operator. On one hand, by linking this operator with other optimality measures, we…

Optimization and Control · Mathematics 2018-05-17 Hui Zhang

The aim of this paper is to solve linear semidefinite programs arising from higher-order Lasserre relaxations of unconstrained binary quadratic optimization problems. For this we use an interior point method with a preconditioned conjugate…

Optimization and Control · Mathematics 2024-12-30 Soodeh Habibi , Michal Kocvara , Michael Stingl

Solving sparse linear systems is a critical challenge in many scientific and engineering fields, particularly when these systems are severely ill-conditioned. This work aims to provide a comprehensive comparison of various solvers designed…

Numerical Analysis · Mathematics 2024-09-24 Marcel Ferrari

The recent introduction of gradient-based MCMC for discrete spaces holds great promise, and comes with the tantalising possibility of new discrete counterparts to celebrated continuous methods such as MALA and HMC. Towards this goal, we…

Machine Learning · Statistics 2022-08-02 Benjamin Rhodes , Michael Gutmann

We revisit the problem of large-scale bundle adjustment and propose a technique called Multidirectional Conjugate Gradients that accelerates the solution of the normal equation by up to 61%. The key idea is that we enlarge the search space…

Computer Vision and Pattern Recognition · Computer Science 2021-10-11 Simon Weber , Nikolaus Demmel , Daniel Cremers

Coarse-graining (CG) of molecular simulations simplifies the particle representation by grouping selected atoms into pseudo-beads and drastically accelerates simulation. However, such CG procedure induces information losses, which makes…

Machine Learning · Computer Science 2022-06-20 Wujie Wang , Minkai Xu , Chen Cai , Benjamin Kurt Miller , Tess Smidt , Yusu Wang , Jian Tang , Rafael Gómez-Bombarelli

Recent advances in the field of machine learning open a new era in high performance computing. Applications of machine learning algorithms for the development of accurate and cost-efficient surrogates of complex problems have already…

Numerical Analysis · Mathematics 2022-08-26 Stefanos Nikolopoulos , Ioannis Kalogeris , Vissarion Papadopoulos , George Stavroulakis

This paper presents a method for building a preconditioner for a kernel ridge regression problem, where the preconditioner is not only effective in its ability to reduce the condition number substantially, but also efficient in its…

Numerical Analysis · Mathematics 2021-04-07 Gil Shabat , Era Choshen , Dvir Ben Or , Nadav Carmel

We present an enhanced version of the row-based randomized block-Kaczmarz method to solve a linear system of equations. This improvement makes use of a regularization during block updates in the solution, and a dynamic proposal distribution…

Numerical Analysis · Mathematics 2025-10-03 Suvendu Kar , Murugesan Venkatapathi

The goal of this paper is to design optimal multilevel solvers for the finite element approximation of second order linear elliptic problems with piecewise constant coefficients on bisection grids. Local multigrid and BPX preconditioners…

Numerical Analysis · Mathematics 2012-02-13 Long Chen , Michael Holst , Jinchao Xu , Yunrong Zhu

The Legendre spectral Galerkin method of self-adjoint second order elliptic equations usually results in a linear system with a dense and ill-conditioned coefficient matrix. In this paper, the linear system is solved by a preconditioned…

Numerical Analysis · Mathematics 2020-04-30 Xuhao Diao , Jun Hu , Suna Ma

Embedding discrete solvers as differentiable layers has given modern deep learning architectures combinatorial expressivity and discrete reasoning capabilities. The derivative of these solvers is zero or undefined, therefore a meaningful…

Machine Learning · Computer Science 2024-12-16 Subham Sekhar Sahoo , Anselm Paulus , Marin Vlastelica , Vít Musil , Volodymyr Kuleshov , Georg Martius

Coarse-graining has become an area of tremendous importance within many different research fields. For molecular simulation, coarse-graining bears the promise of finding simplified models such that long-time simulations of large-scale…

Chemical Physics · Physics 2019-09-04 Feliks Nüske , Lorenzo Boninsegna , Cecilia Clementi

The boundary integral method is an efficient approach for solving time-harmonic obstacle scattering problems by a bounded scatterer. This paper presents the directional preconditioner for the iterative solution of linear systems of the…

Numerical Analysis · Mathematics 2014-09-17 Lexing Ying

The WMAP satellite has made available high quality maps of the sky in five frequency bands ranging from 22 to 94 GHz, with the main scientific objective of studying the anisotropies of the Cosmic Microwave Background (CMB). These maps,…

Astrophysics · Physics 2009-11-13 J. Delabrouille , J. -F. Cardoso , M. Le Jeune , M. Betoule , G. Fay , F. Guilloux

The implementation of the conjugate gradient (CG) method for massive MIMO detection is computationally challenging, especially for a large number of users and correlated channels. In this paper, we propose a low computational complexity CG…

Signal Processing · Electrical Eng. & Systems 2026-04-28 Yiming Fang , Li Chen , Changsheng You , Dingzhu Wen , Pengcheng Zhu

The use of the Preconditioned Conjugate Gradient (PCG) method for computing the Generalized Least Squares (GLS) estimator of the General Linear Model (GLM) is considered. The GLS estimator is expressed in terms of the solution of an…

Numerical Analysis · Mathematics 2025-10-17 Paolo Foschi

The detection of Cosmic Microwave Background primordial $B$-mode polarization would constitute a ``smoking gun" signal of primordial gravitational waves. However, this measurement requires accurate removal of polarized Galactic foregrounds…

Cosmology and Nongalactic Astrophysics · Physics 2026-03-18 Luca Gomez Bachar , Cora Dvorkin , Alberto Daniel Supanitsky