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This study proposes an approach toward the first principles electronic structure calculation with the aid of symbolic-numeric solving. The symbolic computation enables us to express the Hartree-Fock-Roothaan equation and the molecular…

符号计算 · 计算机科学 2013-02-26 Akihito Kikuchi

These notes were written during the 9th and 10th sessions of the subject Dynamical Systems II coursed at DTU (Denmark) during the Winter Semester 2015-2016, and later extended in February 2017. They aim to provide students with a…

动力系统 · 数学 2017-12-12 Albert Granados

The Reduced Basis Method (RBM) is a rigorous model reduction approach for solving parametrized partial differential equations. It identifies a low-dimensional subspace for approximation of the parametric solution manifold that is embedded…

数值分析 · 数学 2018-09-25 Yanlai Chen , Jiahua Jiang , Akil Narayan

The sum-of-squares method can give rigorous lower bounds on the energy of quantum Hamiltonians. Unfortunately, typically using this method requires solving a semidefinite program, which can be computationally expensive. Further, the…

量子物理 · 物理学 2024-12-05 M. B. Hastings

We develop a recursive scheme, as well as polynomial forms (polynomials in $n$ of degree $m$), for the evaluation of Ledin and Brousseau's Fibonacci sums of the form $S(m,n,r)=\sum_{k=1}^nk^mF_{k + r}$, $T(m,n,r)=\sum_{k=1}^nk^mL_{k + r}$…

组合数学 · 数学 2022-08-02 Kunle Adegoke

The so-called Riemann sums have their origin in the efforts of Greek mathematicians to find the center of gravity or the volume of a solid body. These researches led to the method of exhaustion, discovered by Archimedes and described using…

历史与综述 · 数学 2024-04-01 Akerele Olofin Segun

The use of the umbral formalism allows a significant simplification of the derivation of sum rules involving products of special functions and polynomials. We rederive in this way known sum rules and addition theorems for Bessel functions.…

数学物理 · 物理学 2015-06-11 D. Babusci , G. Dattoli , K. Gorska , K. A. Penson

We study nearest-neighbors walks on the two-dimensional square lattice, that is, models of walks on $\mathbb{Z}^2$ defined by a fixed step set that is a subset of the non-zero vectors with coordinates 0, 1 or $-1$. We concern ourselves with…

组合数学 · 数学 2016-10-21 Alin Bostan , Frédéric Chyzak , Mark van Hoeij , Manuel Kauers , Lucien Pech

In a recent work (arXiv-DOI: 1804.08072v1) we introduced the Modified Augmented Lagrangian Method (MALM) for the efficient minimization of objective functions with large quadratic penalty terms. From MALM there results an optimality…

数值分析 · 数学 2018-06-22 Martin Neuenhofen

The ubiquity of the class of D-finite functions and P-recursive sequences in symbolic computation is widely recognized. In this thesis, the presented work consists of two parts related to this class. In the first part, we generalize the…

符号计算 · 计算机科学 2017-10-25 Hui Huang

The paper presents a two-dimensional geometrically nonlinear formulation of a beam element that can accommodate arbitrarily large rotations of cross sections. The formulation is based on the integrated form of equilibrium equations, which…

数值分析 · 数学 2021-04-20 Milan Jirásek , Emma La Malfa Ribolla , Martin Horák

We devise a new accelerated gradient-based estimating sequence technique for solving large-scale optimization problems with composite structure. More specifically, we introduce a new class of estimating functions, which are obtained by…

最优化与控制 · 数学 2021-11-15 Endrit Dosti , Sergiy A. Vorobyov , Themistoklis Charalambous

This paper presents an alternative approach for the computation of trajectory segments on slow manifolds of saddle type. This approach is based on iterative methods rather than collocation-type methods. Compared to collocation methods, that…

动力系统 · 数学 2015-05-07 Kristian Uldall Kristiansen

We study the distribution of $S$-integral points on $\mathrm{SL}_2$-orbit closures of binary forms and prove an asymptotic formula for the number of $S$-integral points of bounded height on $\mathrm{SL}_2$-orbit closures of binary forms.…

数论 · 数学 2017-05-17 Sho Tanimoto , James Tanis

We propose a new multi-instance dynamic RGB-D SLAM system using an object-level octree-based volumetric representation. It can provide robust camera tracking in dynamic environments and at the same time, continuously estimate geometric,…

机器人学 · 计算机科学 2019-03-25 Binbin Xu , Wenbin Li , Dimos Tzoumanikas , Michael Bloesch , Andrew Davison , Stefan Leutenegger

This paper studies an optimization problem on the sum of traces of matrix quadratic forms in $m$ semi-orthogonal matrices, which can be considered as a generalization of the synchronization of rotations. While the problem is nonconvex, the…

最优化与控制 · 数学 2021-10-13 Joong-Ho Won , Teng Zhang , Hua Zhou

The Hill Restricted 4-Body Problem (HR4BP) is a coherent time-periodic model that can be used to represent motion in the Sun-Earth-Moon (SEM) system. Periodic orbits were computed in this model to better understand the periodic orbit family…

动力系统 · 数学 2025-02-03 Gavin M. Brown , Luke T. Peterson , Damennick B. Henry , Daniel J. Scheeres

The optimization version of the cavity method for single instances, called Max-Sum, has been applied in the past to the Minimum Steiner Tree Problem on Graphs and variants. Max-Sum has been shown experimentally to give asymptotically…

数据结构与算法 · 计算机科学 2016-08-03 Alfredo Braunstein , Anna Muntoni

The motion of glaciers can be simulated with the $p$-Stokes equations. Up to now, Newton's method to solve these equations has been analyzed in finite-dimensional settings only. We analyze the problem in infinite dimensions to gain a new…

数值分析 · 数学 2024-09-20 Niko Schmidt

The object of the present paper is to extend the third-order iterative method for solving nonlinear equations into systems of nonlinear equations. Since our motive is to develop the method which improve the order of convergence of Newton's…

数值分析 · 数学 2013-09-24 Anuradha Singh , J. P. Jaiswa
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