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In the framework of the Density Functional Theory for superconductors, we study the restoration of the particle number symmetry by means of the projection technique. Conceptual problems are outlined and numerical difficulties are discussed.…

Nuclear Theory · Physics 2008-12-18 J. Dobaczewski , M. V. Stoitsov , W. Nazarewicz , P. -G. Reinhard

In this paper, we study numerical approximations of the ground states in finite temperature density functional theory. We formulate the problem with respect to the density matrices and justify the convergence of the finite dimensional…

Numerical Analysis · Mathematics 2024-05-14 Ge Xu , Huajie Chen , Xingyu Gao

A central problem in machine learning is often formulated as follows: Given a dataset $\{(x_j, y_j)\}_{j=1}^M$, which is a sample drawn from an unknown probability distribution, the goal is to construct a functional model $f$ such that…

Machine Learning · Computer Science 2026-03-05 Hrushikesh N. Mhaskar , Efstratios Tsoukanis , Ameya D. Jagtap

Is there any theoretical guarantee for the approximation ability of neural networks? The answer to this question is the "Universal Approximation Theorem for Neural Networks". This theorem states that a neural network is dense in a certain…

Machine Learning · Computer Science 2021-02-23 Takato Nishijima

We construct explicit easily implementable polynomial approximations of sufficiently high accuracy for locally constant functions on the union of disjoint segments. This problem has important applications in several areas of numerical…

Functional Analysis · Mathematics 2023-11-29 Yuri Malykhin , Konstantin Ryutin

We present and study approximate notions of dimensional and margin complexity, which correspond to the minimal dimension or norm of an embedding required to approximate, rather then exactly represent, a given hypothesis class. We show that…

Machine Learning · Computer Science 2020-03-10 Pritish Kamath , Omar Montasser , Nathan Srebro

A unified formulation of the density functional theory is constructed on the foundations of entropic inference in both the classical and the quantum regimes. The theory is introduced as an application of entropic inference for inhomogeneous…

Statistical Mechanics · Physics 2021-12-20 Ahmad Yousefi

We prove that the electron density function of a real physical system can be uniquely determined by its values on any finite subsystem. This establishes the existence of a rigorous density-functional theory for any open electronic system.…

Quantum Physics · Physics 2007-05-23 Xiao Zheng , Fan Wang , GuanHua Chen

The theory of descriptive nearness is usually adopted when dealing with sets that share some common properties even when the sets are not spatially close, i.e., the sets have no members in common. Set description results from the use of…

General Topology · Mathematics 2016-09-21 A. Di Concilio , C. Guadagni , J. F. Peters , S. Ramanna

The multiplicative theory of a set of numbers (which could be natural, integer, rational, real or complex numbers) is the first-order theory of the structure of that set with (solely) the multiplication operation (that set is taken to be…

Logic · Mathematics 2021-11-30 Saeed Salehi

Density functional theory can be extended to excited states by means of a unified variational approach for passive state ensembles. This extension overcomes the restriction of the typical density functional approach to ground states, and…

Chemical Physics · Physics 2019-07-10 Tim Gould , Stefano Pittalis

Density functional theory for a simple model of dendrimers is proposed. The theory is based on fundamental measure theory which accounts for the hard-sphere repulsion of the segments and on the Wertheim first-order perturbation theory for…

Soft Condensed Matter · Physics 2012-11-12 Alexandr Malijevsky

We propose a new approach towards approximating the density-to-pair-density map based on copula theory from statistics. We extend the copula theory to multi-dimensional marginals, and deduce that one can describe any (exact or approximate)…

Computational Physics · Physics 2025-03-11 Geneviève Dusson , Claudia Klüppelberg , Gero Friesecke

The following work is written in easy language for college level students. It shows how the first digit probabilities of a group of continuous real-valued functions can be calculated. Thus, examples explaining how the probabilities are…

History and Overview · Mathematics 2021-03-15 Irina Pashchenko

We overview results on the topic of Poisson approximation that are missed in existing surveys. The topic of Poisson approximation to the distribution of a sum of integer-valued random variables is presented as well. We do not restrict…

Probability · Mathematics 2019-04-12 S. Y. Novak

The main purpose of this paper is to prove some density results of polynomials in Fock spaces of slice regular functions. The spaces can be of two different kinds since they are equipped with different inner products and contain different…

Complex Variables · Mathematics 2018-12-10 Kamal Diki , Sorin G. Gal , Irene Sabadini

A method is suggested for treating those complicated physical problems for which exact solutions are not known but a few approximation terms of a calculational algorithm can be derived. The method permits one to answer the following rather…

High Energy Physics - Phenomenology · Physics 2009-10-31 V. I. Yukalov , E. P. Yukalova

The classical Density Functional Theory (DFT) is introduced as an application of entropic inference for inhomogeneous fluids at thermal equilibrium. It is shown that entropic inference reproduces the variational principle of DFT when…

Statistical Mechanics · Physics 2021-09-14 Ahmad Yousefi , Ariel Caticha

In this paper, we extend several approximation theorems, originally formulated in the context of the standard $L^p$ norm, to the more general framework of variable exponent spaces. Our study is motivated by applications in neural networks,…

Functional Analysis · Mathematics 2025-04-22 Mitsuo Izuki , Takahiro Noi , Yoshihiro Sawano , Hirokazu Tanaka

This chapter presents controlled approximations of Kohn-Sham density functional theory (DFT) that enable very large scale simulations. The work is motivated by the study of defects in crystalline solids, though the ideas can be used in…

Materials Science · Physics 2021-12-14 Kaushik Bhattacharya , Vikram Gavini , Michael Ortiz , Mauricio Ponga , Phanish Suryanarayana
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