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The convergence property of a stochastic algorithm for the self-consistent field (SCF) calculations of electron structures is studied. The algorithm is formulated by rewriting the electron charges as a trace/diagonal of a matrix function,…

数值分析 · 数学 2023-04-20 Taehee Ko , Xiantao Li

The dynamic trees problem is to maintain a forest subject to edge insertions and deletions while facilitating queries such as connectivity, path weights, and subtree weights. Dynamic trees are a fundamental building block of a large number…

数据结构与算法 · 计算机科学 2020-10-27 Umut A. Acar , Daniel Anderson , Guy E. Blelloch , Laxman Dhulipala , Sam Westrick

We present a theorem that allows to simplify linear stability analysis of periodic and quasiperiodic nonlinear regimes in N-particle mechanical systems (both conservative and dissipative) with different kinds of discrete symmetry. This…

斑图形成与孤子 · 物理学 2009-11-11 G. M. Chechin , K. G. Zhukov

Optimizations of atomic positions belong to the most commonly performed tasks in electronic structure calculations. Many simulations like global minimum searches or characterizations of chemical reactions require performing hundreds or…

计算物理 · 物理学 2015-01-19 Bastian Schaefer , S. Alireza Ghasemi , Shantanu Roy , Stefan Goedecker

We propose a principled method for autoencoding with random forests. Our strategy builds on foundational results from nonparametric statistics and spectral graph theory to learn a low-dimensional embedding of the model that optimally…

机器学习 · 统计学 2026-01-16 Binh Duc Vu , Jan Kapar , Marvin Wright , David S. Watson

We present a general framework how to investigate stability of solutions within a single self-consistent renormalization scheme being a parquet-type extension of the Baym-Kadanoff construction of conserving approximations. To obtain a…

强关联电子 · 物理学 2009-10-31 V. Janis

We investigate the self-locking of the bowline knot through numerical simulations, experiments, and theoretical analysis. Specifically, we perform two complementary types of simulations using the 3D finite-element method (FEM) and a…

软凝聚态物质 · 物理学 2025-09-15 Bastien F. G. Aymon , Fani Derveni , Michael Gomez , Jérôme Crassous , Pedro M. Reis

The first self-stabilizing algorithm [Dij73] assumed the existence of a central daemon, that activates one processor at time to change state as a function of its own state and the state of a neighbor. Subsequent research has reconsidered…

分布式、并行与集群计算 · 计算机科学 2007-05-23 Shlomi Dolev , Ted Herman

In this paper we investigate the problem of estimating the cluster tree for a density $f$ supported on or near a smooth $d$-dimensional manifold $M$ isometrically embedded in $\mathbb{R}^D$. We analyze a modified version of a $k$-nearest…

We study the problem of solving fixed-point equations for seminorm-contractive operators and establish foundational results on the non-asymptotic behavior of iterative algorithms in both deterministic and stochastic settings. Specifically,…

机器学习 · 计算机科学 2025-02-21 Zaiwei Chen , Sheng Zhang , Zhe Zhang , Shaan Ul Haque , Siva Theja Maguluri

This paper deals with the convergence time analysis of a class of fixed-time stable systems with the aim to provide a new non-conservative upper bound for its settling time. Our contribution is fourfold. First, we revisit the well-known…

Synchronous Counting is the task of reaching agreement on a common round counter in a synchronous system of $n$ nodes with up to $t$ Byzantine faults in a self-stabilizing manner. That is, after transient faults may have arbitrarily…

分布式、并行与集群计算 · 计算机科学 2026-05-19 Christoph Lenzen , Julian Loss

In this article we develop a convergence theory for goal-oriented adaptive finite element algorithms designed for a class of second-order semilinear elliptic equations. We briefly discuss the target problem class, and introduce several…

数值分析 · 数学 2014-04-24 Michael Holst , Sara Pollock , Yunrong Zhu

We consider nonlinear delay differential and renewal equations with infinite delay. We extend the work of Gyllenberg et al, Appl. Math. Comput. (2018) by introducing a unifying abstract framework, and derive a finite-dimensional…

数值分析 · 数学 2024-05-16 Francesca Scarabel , Rossana Vermiglio

This paper addresses the problem of stabilization for infinite-dimensional systems. In particular, we design nonlinear stabilizers for both linear and nonlinear abstract systems. We focus on two classes of systems: the first class comprises…

系统与控制 · 电气工程与系统科学 2025-09-19 Kamal Fenza , Moussa Labbadi , Mohamed Ouzahra

Quantization-Aware Training (QAT) is one of the prevailing neural network compression solutions. However, its stability has been challenged for yielding deteriorating performances as the quantization error is inevitable. We find that the…

计算机视觉与模式识别 · 计算机科学 2025-03-17 Junbiao Pang , Tianyang Cai

In this work, which is based on our previously derived theoretical framework [1], we apply the truncated Born-Bogoliubov-Green-Kirkwood-Yvon (BBGKY) hierarchy for ultracold bosonic systems with a fixed number of particles to two…

量子物理 · 物理学 2018-08-08 Sven Krönke , Peter Schmelcher

We give fault-tolerant algorithms for establishing synchrony in distributed systems in which each of the $n$ nodes has its own clock. Our algorithms operate in a very strong fault model: we require self-stabilisation, i.e., the initial…

分布式、并行与集群计算 · 计算机科学 2019-06-12 Christoph Lenzen , Joel Rybicki

In this work, we are concerned with the stability and convergence analysis of the second order BDF (BDF2) scheme with variable steps for the molecular beam epitaxial model without slope selection. We first show that the variable-step BDF2…

数值分析 · 数学 2022-01-05 Hong-lin Liao , Xuehua Song , Tao Tang , Tao Zhou

This paper extends algorithms that remove the fixed point bias of decentralized gradient descent to solve the more general problem of distributed optimization over subspace constraints. Leveraging the integral quadratic constraint…

最优化与控制 · 数学 2022-10-31 Dennis J. Marquis , Dany Abou Jaoude , Mazen Farhood , Craig A. Woolsey