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20082026
most citedGraph-based linear scaling electronic structure theory

36 citations · 164 across the 19 of their papers we have counts for

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7 papers · 1 filter

math.NA2026

Recursive expansion of the matrix step function using polynomials of degree eight

Emanuel H. Rubensson, Elias Jarlebring, Gustaf Lorentzon

We consider the problem of efficiently computing the matrix step function of a large dense symmetric matrix. To this end, we introduce a recursive polynomial expansion method in wh…

math.NA2023

Higher order derivatives of matrix functions

Emanuel H. Rubensson

We present theory for general partial derivatives of matrix functions on the form where is a matrix path of several variables (). Building on re…

math.NA2020★ 2 cited

Sparse approximate matrix-matrix multiplication for density matrix purification with error control

Anton G. Artemov, Emanuel H. Rubensson

We propose a method for strict error control in sparse approximate matrix-matrix multiplication. The method combines an error bound and a parameter sweep to select an appropriate t…

math.NA2019★ 2 cited

Parallelization and scalability analysis of inverse factorization using the Chunks and Tasks programming model

Anton G. Artemov, Elias Rudberg, Emanuel H. Rubensson

We present three methods for distributed memory parallel inverse factorization of block-sparse Hermitian positive definite matrices. The three methods are a recursive variant of th…

math.NA2018

Localized inverse factorization

Emanuel H. Rubensson, Anton G. Artemov, Anastasia Kruchinina +1

We propose a localized divide and conquer algorithm for inverse factorization of Hermitian positive definite matrices with localized structure, e.g. exponential…

math.NA2018

A density matrix approach to the convergence of the self-consistent field iteration

Parikshit Upadhyaya, Elias Jarlebring, Emanuel H. Rubensson

In this paper, we present a local convergence analysis of the self-consistent field (SCF) iteration using the density matrix as the state of a fixed-point iteration. Sufficient and…

math.NA2012★ 4 cited

On the condition number and perturbation of matrix functions for Hermitian matrices

Elias Jarlebring, Emanuel H. Rubensson

Consider a matrix function f defined for Hermitian matrices. The purpose of this paper is two-fold. We derive new results for the absolute structured condition number of the matrix…