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We develop convergence acceleration procedures that enable a gradient descent-type iteration method to efficiently simulate Hartree--Fock equations for atoms interacting both with each other and with an external potential. Our development…

Computational Physics · Physics 2025-03-03 Y. Ohno , A. Del Maestro , T. I. Lakoba

Current trends in the computer graphics community propose leveraging the massive parallel computational power of GPUs to accelerate physically based simulations. Collision detection and solving is a fundamental part of this process. It is…

Graphics · Computer Science 2021-10-06 Hugo Bertiche , Meysam Madadi , Sergio Escalera

Proximal methods are known to identify the underlying substructure of nonsmooth optimization problems. Even more, in many interesting situations, the output of a proximity operator comes with its structure at no additional cost, and…

Optimization and Control · Mathematics 2023-02-10 Gilles Bareilles , Franck Iutzeler , Jérôme Malick

This paper studies a distributed multi-agent convex optimization problem. The system comprises multiple agents in this problem, each with a set of local data points and an associated local cost function. The agents are connected to a…

Optimization and Control · Mathematics 2021-08-20 Kushal Chakrabarti , Nirupam Gupta , Nikhil Chopra

Low-precision arithmetic has had a transformative effect on the training of neural networks, reducing computation, memory and energy requirements. However, despite its promise, low-precision arithmetic has received little attention for…

Machine Learning · Computer Science 2022-07-15 Wesley J. Maddox , Andres Potapczynski , Andrew Gordon Wilson

Parameter-specific adaptive learning rate methods are computationally efficient ways to reduce the ill-conditioning problems encountered when training large deep networks. Following recent work that strongly suggests that most of the…

Machine Learning · Computer Science 2015-09-01 Yann N. Dauphin , Harm de Vries , Yoshua Bengio

Cardiac muscle tissue during relaxation is commonly modelled as a hyperelastic material with strongly nonlinear and anisotropic stress response. Adapting the behavior of such a model to experimental or patient data gives rise to a parameter…

Tissues and Organs · Quantitative Biology 2016-03-16 Gabriel Balaban , Martin S. Alnæs , Joakim Sundnes , Marie E. Rognes

This work proposes a hyper-reduction method for nonlinear parametric dynamical systems characterized by gradient fields such as Hamiltonian systems and gradient flows. The gradient structure is associated with conservation of invariants or…

Numerical Analysis · Mathematics 2023-07-24 Cecilia Pagliantini , Federico Vismara

Solving a set of simultaneous linear equations is probably the most important topic in numerical methods. For solving linear equations, iterative methods are preferred over the direct methods especially when the coefficient matrix is…

Neural and Evolutionary Computing · Computer Science 2013-04-09 R. M. Jalal Uddin Jamali , M. M. A. Hashem , M. Mahfuz Hasan , Md. Bazlar Rahman

Interior-point methods offer a highly versatile framework for convex optimization that is effective in theory and practice. A key notion in their theory is that of a self-concordant barrier. We give a suitable generalization of…

Optimization and Control · Mathematics 2024-06-26 Hiroshi Hirai , Harold Nieuwboer , Michael Walter

We present a novel convex formulation that weakly couples the Material Point Method (MPM) with rigid body dynamics through frictional contact, optimized for efficient GPU parallelization. Our approach features an asynchronous time-splitting…

Robotics · Computer Science 2025-07-08 Chang Yu , Wenxin Du , Zeshun Zong , Alejandro Castro , Chenfanfu Jiang , Xuchen Han

Simulations of many rigid bodies colliding with each other sometimes yield particularly interesting results if the colliding objects differ significantly in size and are non-spherical. The most expensive part within such a simulation code…

Computational Geometry · Computer Science 2022-10-21 Peter J. Noble , Tobias Weinzierl

In this paper, we propose two mixed precision algorithms for Block-Jacobi preconditioner(BJAC): a fixed low precision strategy and an adaptive precision strategy. We evaluate the performance improvement of the proposed mixed precision BJAC…

Numerical Analysis · Mathematics 2024-10-16 Ningxi Tian , Silu Huang , Xiaowen Xu

Feedforward computation, such as evaluating a neural network or sampling from an autoregressive model, is ubiquitous in machine learning. The sequential nature of feedforward computation, however, requires a strict order of execution and…

Machine Learning · Computer Science 2021-06-15 Yang Song , Chenlin Meng , Renjie Liao , Stefano Ermon

In this technical note we show how to reach a remarkable speed up when solving elliptic partial differential equations with finite differences thanks to the joint use of the Chebyshev-Jacobi method with high order discretizations and its…

Numerical Analysis · Mathematics 2017-05-02 J. E. Adsuara , M. A. Aloy , P. Cerdá-Durán , I. Cordero-Carrión

Primal-Dual Interior-Point methods are capable of solving constrained convex optimization problems to tight tolerances in a fast and robust manner. The derivatives of the primal-dual solution with respect to the problem matrices can be…

Optimization and Control · Mathematics 2024-06-21 Kevin Tracy , Zachary Manchester

We propose an optimization proxy in terms of iterative implicit gradient methods for solving constrained optimization problems with nonconvex loss functions. This framework can be applied to a broad range of machine learning settings,…

Optimization and Control · Mathematics 2025-10-14 Harshal D. Kaushik , Ming Jin

We present a relative forward error analysis of a mixed-precision preconditioned one-sided Jacobi algorithm, analogous to a two-sided version introduced in [N. J. Higham, F. Tisseur, M. Webb and Z. Zhou, SIAM J. Matrix Anal. Appl. 46…

Numerical Analysis · Mathematics 2026-02-23 Zhengbo Zhou , Françoise Tisseur , Marcus Webb

The conjugate gradient (CG) method is widely used for solving nonlinear unconstrained optimization problems because it requires less memory to implement. In this paper, we propose a new parameter of the Dai Liao conjugacy condition of the…

Optimization and Control · Mathematics 2024-12-24 Ahmad Alhawarat

The linear primal-dual hybrid gradient (PDHG) method is a first-order method that splits convex optimization problems with saddle-point structure into smaller subproblems. Unlike those obtained in most splitting methods, these subproblems…

Optimization and Control · Mathematics 2022-04-05 Jérôme Darbon , Gabriel P. Langlois