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An implicit purification scheme is proposed for calculation of the temperature-dependent, grand canonical single-particle density matrix, given as a Fermi operator expansion in terms of the Hamiltonian. The computational complexity is shown…

Materials Science · Physics 2009-11-10 Anders M. N. Niklasson

The (Non-Preemptive) Throughput Maximization problem is a natural and fundamental scheduling problem. We are given $n$ jobs, where each job $j$ is characterized by a processing time and a time window, contained in a global interval $[0,T)$,…

Data Structures and Algorithms · Computer Science 2026-04-01 Alexander Armbruster , Fabrizio Grandoni , Antoine Tinguely , Andreas Wiese

We present an approximate algorithm for matrix multiplication based on matrix sketching techniques. First one of the matrix is chosen and sparsified using the online matrix sketching algorithm, and then the matrix product is calculated…

Numerical Analysis · Computer Science 2014-06-12 Huan Wang , Christos Boutsidis , Edo Liberty , Daniel Hsu

We consider partially directed walks crossing a $L\times L$ square weighted according to their length by a fugacity $t$. The exact solution of this model is computed in three different ways, depending on whether $t$ is less than, equal to…

Statistical Mechanics · Physics 2023-04-05 Nicholas R. Beaton , Aleksander L. Owczarek

This contribution features an accelerated computation of the Sinkhorn's algorithm, which approximates the Wasserstein transportation distance, by employing nonequispaced fast Fourier transforms (NFFT). The algorithm proposed allows…

Optimization and Control · Mathematics 2023-03-07 Rajmadan Lakshmanan , Alois Pichler , Daniel Potts

The nonlinear Fourier transform (NFT) has recently gained significant attention in fiber optic communications and other engineering fields. Although several numerical algorithms for computing the NFT have been published, the design of…

Signal Processing · Electrical Eng. & Systems 2019-10-17 Shrinivas Chimmalgi , Peter J. Prins , Sander Wahls

Real time, density matrix based, time dependent density functional theory proceeds through the propagation of the density matrix, as opposed to the Kohn-Sham orbitals. It is possible to reduce the computational workload by imposing spatial…

Computational Physics · Physics 2015-05-20 Conn O'Rourke , David R. Bowler

In this paper, we begin the exploration of vertex-ordering problems through the lens of exponential-time approximation algorithms. In particular, we ask the following question: Can we simultaneously beat the running times of the fastest…

Data Structures and Algorithms · Computer Science 2025-02-18 Matthias Bentert , Fedor V. Fomin , Tanmay Inamdar , Saket Saurabh

We investigate sparse matrix bipartitioning -- a problem where we minimize the communication volume in parallel sparse matrix-vector multiplication. We prove, by reduction from graph bisection, that this problem is $\mathcal{NP}$-complete…

Data Structures and Algorithms · Computer Science 2020-05-08 Timon E. Knigge , Rob H. Bisseling

It is known that a single product shock measure in some of one-dimensional driven-diffusive systems with nearest-neighbor interactions might evolve in time quite similar to a random walker moving on a one-dimensional lattice with reflecting…

Statistical Mechanics · Physics 2015-05-14 Farhad H. Jafarpour , Somayeh Zeraati

Strong multiple scattering of the probe in scanning transmission electron microscopy (STEM) means image simulations are usually required for quantitative interpretation and analysis of elemental maps produced by electron energy-loss…

Materials Science · Physics 2019-12-25 Hamish G. Brown , Jim Ciston , Colin Ophus

We give an algorithm to compute $N$ steps of a convolution quadrature approximation to a continuous temporal convolution using only $O(N \log N)$ multiplications and $O(\log N)$ active memory. The method does not require evaluations of the…

Numerical Analysis · Mathematics 2011-11-10 Achim Schädle , María López-Fernández , Christian Lubich

This PhD thesis summarizes research works on the design of exact algorithms that provide a worst-case (time or space) guarantee for NP-hard scheduling problems. Both theoretical and practical aspects are considered with three main results…

Computational Complexity · Computer Science 2017-12-07 Lei Shang

We construct a deterministic approximation algorithm for computing a permanent of a $0,1$ $n$ by $n$ matrix to within a multiplicative factor $(1+\epsilon)^n$, for arbitrary $\epsilon>0$. When the graph underlying the matrix is a constant…

Combinatorics · Mathematics 2007-05-23 David Gamarnik , Dmitriy Katz

The estimation of high dimensional precision matrices has been a central topic in statistical learning. However, as the number of parameters scales quadratically with the dimension $p$, many state-of-the-art methods do not scale well to…

Computation · Statistics 2019-07-10 Cheng Wang , Binyan Jiang

We present a new algorithm for reconstructing an exact algebraic number from its approximate value using an improved parameterized integer relation construction method. Our result is consistent with the existence of error controlling on…

Computational Complexity · Computer Science 2009-02-06 Xiaolin Qin , Yong Feng , Jingwei Chen , Jingzhong Zhang

In this paper a new fast algorithm for the computation of the distance of a matrix to a nearby defective matrix is presented. The problem is formulated following Alam & Bora (Linear Algebra Appl., 396 (2005), pp.~273--301) and reduces to…

Numerical Analysis · Mathematics 2012-11-05 Melina A. Freitag , Alastair Spence

An algorithm is presented for the efficient and accurate computation of the coefficients of the characteristic polynomial of a general square matrix. The algorithm is especially suited for the evaluation of canonical traces in determinant…

Numerical Analysis · Mathematics 2025-10-20 S. Rombouts , K. Heyde

Polynomial approximations to the inverse of the fermion matrix are used to filter the dynamics of the upper energy scales in HMC simulations. The use of a multiple time-scale integration scheme allows the filtered pseudofermions to be…

High Energy Physics - Lattice · Physics 2015-05-28 Waseem Kamleh , Mike Peardon

The distance transform algorithm is popular in computer vision and machine learning domains. It is used to minimize quadratic functions over a grid of points. Felzenszwalb and Huttenlocher (2004) describe an O(N) algorithm for computing the…

Computational Geometry · Computer Science 2019-08-06 Mihir Sahasrabudhe , Siddhartha Chandra