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This paper introduces a novel general-purpose algorithm for Pauli decomposition that employs matrix slicing and addition rather than expensive matrix multiplication, significantly accelerating the decomposition of multi-qubit matrices. In a…

Quantum Physics · Physics 2024-09-25 Lukas Hantzko , Lennart Binkowski , Sabhyata Gupta

The Fourier transforms of polyhedral cones can be used, via Brion's theorem, to compute various geometric quantities of polytopes, such as volumes, moments, and lattice-point counts. We present a novel method of computing these conic…

Combinatorics · Mathematics 2018-08-02 Quang-Nhat Le

We propose a unique scheme to construct fully optimized atomic basis sets for density-functional calculations. The shapes of the radial functions are optimized by minimizing the {\it spillage} of the wave functions between the atomic…

Materials Science · Physics 2015-05-19 Mohan Chen , G-C Guo , Lixin He

Motivated by a connection with the factorization of multivariate polynomials, we study integral convex polytopes and their integral decompositions in the sense of the Minkowski sum. We first show that deciding decomposability of integral…

Combinatorics · Mathematics 2007-05-23 S. Gao , A. G. B. Lauder

We describe how to construct and enumerate Magic squares, Franklin squares, Magic cubes, and Magic graphs as lattice points inside polyhedral cones using techniques from Algebraic Combinatorics. The main tools of our methods are the Hilbert…

Combinatorics · Mathematics 2007-05-23 Maya Mohsin Ahmed

The performance of basis sets made of numerical atomic orbitals is explored in density-functional calculations of solids and molecules. With the aim of optimizing basis quality while maintaining strict localization of the orbitals, as…

Materials Science · Physics 2009-11-07 Javier Junquera , Oscar Paz , Daniel Sanchez-Portal , Emilio Artacho

We introduce a Bernstein-Bezier basis for the pyramid, whose restriction to the face reduces to the Bernstein-Bezier basis on the triangle or quadrilateral. The basis satisfies the standard positivity and partition of unity properties…

Numerical Analysis · Mathematics 2015-08-25 Jesse Chan , T. Warburton

In this paper we propose a novel efficient algorithm for calculating winding numbers, aiming at counting the number of roots of a given polynomial in a convex region on the complex plane. This algorithm can be used for counting and…

Numerical Analysis · Mathematics 2019-08-20 Vitaly Zaderman , Liang Zhao

In the paper, we give methods of construction of dual bases for the B-spline basis and truncated power basis. Explicit formulas for the dual B-spline basis are obtained using the Legendre-like orthogonal basis of the polynomial spline space…

Numerical Analysis · Mathematics 2017-07-24 Przemysław Gospodarczyk , Paweł Woźny

We consider polynomials of a few linear forms and show how exploit this type of sparsity for optimization on some particular domains like the Euclidean sphere or a polytope. Moreover, a simple procedure allows to detect this form of…

Optimization and Control · Mathematics 2022-04-05 Jean-Bernard Lasserre

We present a simple algorithm for computing higher-order Delaunay mosaics that works in Euclidean spaces of any finite dimensions. The algorithm selects the vertices of the order-$k$ mosaic from incrementally constructed lower-order mosaics…

Computational Geometry · Computer Science 2020-11-10 Herbert Edelsbrunner , Georg Osang

For systems of polynomial equations, we study the problem of computing the Newton polytope of their eliminants. As was shown by Esterov and Khovanskii, such Newton polytopes are mixed fiber polytopes of the Newton polytopes of the input…

Symbolic Computation · Computer Science 2025-03-17 Rafael Mohr , Yulia Mukhina

The aim of this work is to introduce several different volume computation methods of the graph polytope associated with various type of finite simple graphs. Among them, we obtained the recursive volume formula (RVF) that is fundamental and…

Combinatorics · Mathematics 2015-07-29 Daeseok Lee , Hyeong-Kwan Ju

This article presents a new method to compute matrices from numerical simulations based on the ideas of sparse sampling and compressed sensing. The method is useful for problems where the determination of the entries of a matrix constitutes…

Chemical Physics · Physics 2014-10-21 Jacob N. Sanders , Xavier Andrade , Alán Aspuru-Guzik

Standard integration-by-parts (IBP) reduction methods typically yield Feynman integral bases where the reduction of some integrals gives rise to coefficients singular as the dimensional regulator $\epsilon\rightarrow 0$. These singular…

High Energy Physics - Theory · Physics 2025-08-07 Stefano De Angelis , David A. Kosower , Rourou Ma , Zihao Wu , Yang Zhang

A split of a polytope is a (necessarily regular) subdivision with exactly two maximal cells. A polytope is totally splittable if each triangulation (without additional vertices) is a common refinement of splits. This paper establishes a…

Combinatorics · Mathematics 2014-12-23 Sven Herrmann , Michael Joswig

The bending of bilayer plates is a mechanism which allows for large deformations via small externally induced lattice mismatches of the underlying materials. Its mathematical modeling, discussed herein, consists of a nonlinear fourth order…

Numerical Analysis · Mathematics 2015-10-09 Söeren Bartels , Andrea Bonito , Ricardo H. Nochetto

This paper generalizes the result of Elmachtoub et al to any weighted barycenter, where a transformation is considered which takes an arbitrary point of division $\xi \in (0,1)$ of the segments of a polygon with $n$ vertices. We then…

Metric Geometry · Mathematics 2016-06-30 Keller VandeBogert

We develop a collection of numerical algorithms which connect ideas from polyhedral geometry and algebraic geometry. The first algorithm we develop functions as a numerical oracle for the Newton polytope of a hypersurface and is based on…

Algebraic Geometry · Mathematics 2020-04-28 Taylor Brysiewicz

Our contribution is two-folded. First, starting from the known fact that every real skew-Hamiltonian matrix has a real Hamiltonian square root, we give a complete characterization of the square roots of a real skew-Hamiltonian matrix W.…

Numerical Analysis · Mathematics 2012-01-25 Zhongyun Liu , Yulin Zhang , Carla Ferreira , Rui Ralha
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