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Optimally hybrid numerical solvers were constructed for massively parallel generalized eigenvalue problem (GEP).The strong scaling benchmark was carried out on the K computer and other supercomputers for electronic structure calculation…

计算物理 · 物理学 2016-02-10 Hiroto Imachi , Takeo Hoshi

The solution of (generalized) eigenvalue problems for symmetric or Hermitian matrices is a common subtask of many numerical calculations in electronic structure theory or materials science. Solving the eigenvalue problem can easily amount…

数学软件 · 计算机科学 2020-01-08 P. Kus , A. Marek , S. S. Koecher , H. -H. Kowalski , C. Carbogno , Ch. Scheurer , K. Reuter , M. Scheffler , H. Lederer

This paper presents a parallel algorithm for finding the smallest eigenvalue of a particular form of ill-conditioned Hankel matrix, which requires the use of extremely high precision arithmetic. Surprisingly, we find that commonly-used…

数值分析 · 数学 2009-02-06 Niall Emmart , Charles C. Weems , Yang Chen

We present a high-performance solver for dense skew-symmetric matrix eigenvalue problems. Our work is motivated by applications in computational quantum physics, where one solution approach to solve the so-called Bethe-Salpeter equation…

数值分析 · 数学 2020-06-05 Carolin Penke , Andreas Marek , Christian Vorwerk , Claudia Draxl , Peter Benner

We propose a novel parallel numerical algorithm for calculating the smallest eigenvalues of highly ill-conditioned matrices. It is based on the {\it LDLT} decomposition and involves finding a $k \times k$ sub-matrix of the inverse of the…

数值分析 · 数学 2018-10-04 Yang Chen , Jakub Sikorowski , Mengkun Zhu

We introduce a new collection of solvers - subsequently called EleMRRR - for large-scale dense Hermitian eigenproblems. EleMRRR solves various types of problems: generalized, standard, and tridiagonal eigenproblems. Among these, the last is…

数学软件 · 计算机科学 2012-09-27 Matthias Petschow , Elmar Peise , Paolo Bientinesi

SLEPc is a parallel library for the solution of various types of large-scale eigenvalue problems. In the last years we have been developing a module within SLEPc, called NEP, that is intended for solving nonlinear eigenvalue problems. These…

数学软件 · 计算机科学 2021-06-29 Carmen Campos , Jose E. Roman

We study a distributed Principal Component Analysis (PCA) framework where each worker targets a distinct eigenvector and refines its solution by updating from intermediate solutions provided by peers deemed as "superior". Drawing intuition…

机器学习 · 计算机科学 2025-02-27 Fangshuo Liao , Wenyi Su , Anastasios Kyrillidis

Kernel-based methods in Numerical Analysis have the advantage of yielding optimal recovery processes in the "native" Hilbert space $\calh$ in which they are reproducing. Continuous kernels on compact domains have an expansion into…

数值分析 · 数学 2018-10-09 Gabriele Santin , Robert Schaback

Kernel methods are successful approaches for different machine learning problems. This success is mainly rooted in using feature maps and kernel matrices. Some methods rely on the eigenvalues/eigenvectors of the kernel matrix, while for…

机器学习 · 计算机科学 2012-02-20 Nima Reyhani , Hideitsu Hino , Ricardo Vigario

Accurately estimate performance of currently available processors is becoming a key activity, particularly in HENP environment, where high computing power is crucial. This document describes the methods and programs, opensource or freeware,…

高能物理 - 实验 · 物理学 2007-05-23 R. Esposito , P. Mastroserio , G. Tortone , F. M. Taurino

Recent studies indicate that kernel machines can often perform similarly or better than deep neural networks (DNNs) on small datasets. The interest in kernel machines has been additionally bolstered by the discovery of their equivalence to…

机器学习 · 计算机科学 2023-06-21 Amirhesam Abedsoltan , Mikhail Belkin , Parthe Pandit

In this paper we first identify a basic limitation in gradient descent-based optimization methods when used in conjunctions with smooth kernels. An analysis based on the spectral properties of the kernel demonstrates that only a vanishingly…

机器学习 · 统计学 2017-06-20 Siyuan Ma , Mikhail Belkin

With the emergence of Artificial Intelligence, numerical algorithms are moving towards more approximate approaches. For methods such as PCA or diffusion maps, it is necessary to compute eigenvalues of a large matrix, which may also be dense…

数值分析 · 数学 2023-11-17 Keerthi Gaddameedi , Severin Reiz , Tobias Neckel , Hans-Joachim Bungartz

The ability to model, analyze, and predict execution time of computations is an important building block supporting numerous efforts, such as load balancing, performance optimization, and automated performance tuning for high performance,…

性能 · 计算机科学 2020-06-22 James D. Stevens , Andreas Klöckner

AcceleratedKernels.jl is introduced as a backend-agnostic library for parallel computing in Julia, natively targeting NVIDIA, AMD, Intel, and Apple accelerators via a unique transpilation architecture. Written in a unified, compact…

分布式、并行与集群计算 · 计算机科学 2025-07-23 Andrei-Leonard Nicusan , Dominik Werner , Simon Branford , Simon Hartley , Andrew J. Morris , Kit Windows-Yule

Efficient implementations of HPC applications for parallel architectures generally rely on external software packages (e.g., BLAS, LAPACK, CUDNN). While these libraries provide highly optimized routines for certain characteristics of inputs…

分布式、并行与集群计算 · 计算机科学 2018-02-16 Philippe Tillet , David Cox

Porting applications to new hardware or programming models is a tedious and error prone process. Every help that eases these burdens is saving developer time that can then be invested into the advancement of the application itself instead…

分布式、并行与集群计算 · 计算机科学 2016-11-07 Erik Zenker , Benjamin Worpitz , René Widera , Axel Huebl , Guido Juckeland , Andreas Knüpfer , Wolfgang E. Nagel , Michael Bussmann

Large-scale eigenvalue computations on sparse matrices are a key component of graph analytics techniques based on spectral methods. In such applications, an exhaustive computation of all eigenvalues and eigenvectors is impractical and…

硬件体系结构 · 计算机科学 2021-03-19 Francesco Sgherzi , Alberto Parravicini , Marco Siracusa , Marco Domenico Santambrogio
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