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We present a simple formalism for the calculation of the derivatives of the electronic density matrix at any order, within density functional theory. Our approach, contrary to previous ones, is not based on the perturbative expansion of the…

Materials Science · Physics 2009-11-10 Michele Lazzeri , Francesco Mauri

The general number field sieve (GNFS) is the most efficient algorithm known for factoring large integers. It consists of several stages, the first one being polynomial selection. The quality of the chosen polynomials in polynomial selection…

Number Theory · Mathematics 2015-08-18 Shi Bai , Richard P. Brent , Emmanuel Thomé

Many real phenomena may be modelled as random closed sets in $\mathbb{R}^d$, of different Hausdorff dimensions. In many real applications, such as fiber processes and $n$-facets of random tessellations of dimension $n\leq d$ in spaces of…

Statistics Theory · Mathematics 2010-01-14 Luigi Ambrosio , Vincenzo Capasso , Elena Villa

In this paper we prove local-global principles for embedding of fields with involution into central simple algebras with involution over a global field. These should be of interest in study of classical groups over global fields. We deduce…

Number Theory · Mathematics 2009-07-02 Gopal Prasad , Andrei S. Rapinchuk

To compute solutions of sparse polynomial systems efficiently we have to exploit the structure of their Newton polytopes. While the application of polyhedral methods naturally excludes solutions with zero components, an irreducible…

Symbolic Computation · Computer Science 2014-05-05 Danko Adrovic , Jan Verschelde

This article introduces a general statistical modeling principle called "Density Sharpening" and applies it to the analysis of discrete count data. The underlying foundation is based on a new theory of nonparametric approximation and…

Methodology · Statistics 2021-08-24 Subhadeep Mukhopadhyay

Let $f\in\mathbb{Z}[T]$ be any polynomial of degree $d>1$ and $F\in\mathbb{Z}[X_{0},...,X_{n}]$ an irreducible homogeneous polynomial of degree $e>1$ such that the projective hypersurface $V(F)$ is smooth. In this paper we give a bound for…

Number Theory · Mathematics 2019-06-10 Dante Bonolis

The large sieve is used to estimate the density of integral quadratic polynomials $Q$, such that there exists an odd degree integral polynomial which has resultant $\pm 1$ with $Q$. Given a monic integral polynomial $R$ of odd degree, this…

Number Theory · Mathematics 2025-06-13 Tim Browning , Stephanie Chan

In the present paper we generate binary pseudorandom sequences using generalized polynomials. A generalized polynomial is a function in whose description we not only allow addition and product (as it is the case in usual polynomials) but…

Number Theory · Mathematics 2025-09-25 Manfred G. Madritsch , Robert F. Tichy

We establish that the optimal bound for the size of the smallest integral solution of the Oppenheim Diophantine approximation problem $\abs{Q(x)-\xi}< \epsilon$ for a generic ternary form $Q$ is $\abs{x}\ll \epsilon^{-1}$. We also establish…

Number Theory · Mathematics 2018-01-04 Anish Ghosh , Alexander Gorodnik , Amos Nevo

A recently proposed linear-scaling scheme for density-functional pseudopotential calculations is described in detail. The method is based on a formulation of density functional theory in which the ground state energy is determined by…

mtrl-th · Physics 2009-10-28 E. Hernandez , C. M. Goringe , M. J. Gillan

A method is described which allows to evaluate efficiently a polynomial in a (possibly trivial) extension of the finite field of its coefficients. Its complexity is shown to be lower than that of standard techniques when the degree of the…

Information Theory · Computer Science 2011-02-24 Davide Schipani , Michele Elia , Joachim Rosenthal

We introduce a density basis of the trigonometric polynomials that is suitable to mixture modelling. Statistical and geometric properties are derived, suggesting it as a circular analogue to the Bernstein polynomial densities. Nonparametric…

Methodology · Statistics 2019-02-26 Olivier Binette , Simon Guillotte

The Hohenberg-Kohn theorem of density-functional theory (DFT) is broadly considered the conceptual basis for a full characterization of an electronic system in its ground state by just the one-body particle density. Part I of this review…

In this paper we present a locally and dimension-adaptive sparse grid method for interpolation and integration of high-dimensional functions with discontinuities. The proposed algorithm combines the strengths of the generalised sparse grid…

Numerical Analysis · Mathematics 2011-10-04 John D. Jakeman , Stephen G. Roberts

We develop two methods for expressing the global index of the gradient of a 2 variable polynomial function $f$: in terms of the atypical fibres of $f$, and in terms of the clusters of Milnor arcs at infinity. These allow us to derive upper…

Algebraic Geometry · Mathematics 2024-10-30 Gabriel E. Monsalve , Mihai Tibăr

Over-parameterized models like deep nets and random forests have become very popular in machine learning. However, the natural goals of continuity and differentiability, common in regression models, are now often ignored in modern…

Machine Learning · Computer Science 2023-10-16 Mingxuan Han , Varun Shankar , Jeff M Phillips , Chenglong Ye

We are concerned with the computation of the ${\mathcal L}_\infty$-norm for an ${\mathcal L}_\infty$-function of the form $H(s) = C(s) D(s)^{-1} B(s)$, where the middle factor is the inverse of a meromorphic matrix-valued function, and…

Numerical Analysis · Mathematics 2017-06-06 Nicat Aliyev , Peter Benner , Emre Mengi , Paul Schwerdtner , Matthias Voigt

A density-functional theory is developed based on the Maxwell--Schr\"odinger equation with an internal magnetic field in addition to the external electromagnetic potentials. The basic variables of this theory are the electron density and…

Chemical Physics · Physics 2018-01-17 Erik Tellgren

This paper extends earlier work on the distribution in the complex plane of the roots of random polynomials. In this paper, the random polynomials are generalized to random finite sums of given "basis" functions. The basis functions are…

Probability · Mathematics 2016-08-04 Robert J. Vanderbei