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In this work, an adaptive edge element method is developed for an H(curl)-elliptic constrained optimal control problem. We use the lowest-order Nedelec's edge elements of first family and the piecewise (element-wise) constant functions to…

数值分析 · 数学 2021-06-30 Bowen Li , Jun Zou

We introduce a data-driven framework for approximating the convex set of $N$-representable two-electron reduced density matrices (2-RDMs). Traditional approaches characterize this set through linear matrix inequalities that define its…

化学物理 · 物理学 2026-03-09 Luis H. Delgado-Granados , David A. Mazziotti

The reduced dimensionality in two-dimensional materials leads a wealth of unusual properties, which are currently explored for both fundamental and applied sciences. In order to study the crystal structure, edge states, the formation of…

介观与纳米尺度物理 · 物理学 2021-01-04 Felix Kern , Martin Linck , Daniel Wolf , Nasim Alem , Himani Arora , Sibylle Gemming , Artur Erbe , Alex Zettl , Bernd Büchner , Axel Lubk

Parametric two-electron reduced-density-matrix (p-2RDM) methods have enjoyed much success in recent years; the methods have been shown to exhibit accuracies greater than coupled cluster with single and double substitutions (CCSD) for both…

化学物理 · 物理学 2010-09-02 A. Eugene DePrince , David A. Mazziotti

We explore the mathematical and numerical aspects of reconstructing a potential energy profile of a molecular bond from its rupture time distribution. While reliable reconstruction of gross attributes, such as the height and the width of an…

统计力学 · 物理学 2015-05-18 Pak-Wing Fok , Tom Chou

This contribution addresses the problem of image reconstruction of radioactivity distribution for which the available information arises from several classes of data, each associated with a specific combination of detections. We introduce a…

应用统计 · 统计学 2023-09-12 Mehdi Latif , Jérôme Idier , Thomas Carlier , Simon Stute

This paper presents two new approaches for finding the homogenized coefficients of multiscale elliptic PDEs. Standard approaches for computing the homogenized coefficients suffer from the so-called resonance error, originating from a…

数值分析 · 数学 2024-12-20 Assyr Abdulle , Doghonay Arjmand , Edoardo Paganoni

We propose a sampling-based method for computing the tensor ring (TR) decomposition of a data tensor. The method uses leverage score sampled alternating least squares to fit the TR cores in an iterative fashion. By taking advantage of the…

数值分析 · 数学 2021-07-12 Osman Asif Malik , Stephen Becker

With the aim of constructing an electronic structure approach that systematically goes beyond the GW and random phase approximation (RPA) we introduce a vertex correction based on the exact-exchange (EXX) potential of time-dependent density…

材料科学 · 物理学 2018-07-16 Maria Hellgren , Nicola Colonna , Stefano de Gironcoli

Designing large coupling memory quasi-cyclic spatially-coupled LDPC (QC-SC-LDPC) codes with low error floors requires eliminating specific harmful substructures (e.g., short cycles) induced by edge spreading and lifting. Building on our…

信息论 · 计算机科学 2026-01-21 Lei Huang

Total-reflection high-energy positron diffraction (TRHEPD) is a novel experimental method for the determination of surface structure, which has been extensively developed at the Slow Positron Facility, Institute of Materials Structure…

When electrically stimulated, electroactive polymers (EAPs) respond with mechanical deformation. The goal of this work is to design electrode and EAP layouts simultaneously in structures by using density-based, multi-material topology…

计算工程、金融与科学 · 计算机科学 2024-12-05 Daniel Hård , Mathias Wallin , Matti Ristinmaa

Modern data-driven and distributed learning frameworks deal with diverse massive data generated by clients spread across heterogeneous environments. Indeed, data heterogeneity is a major bottleneck in scaling up many distributed learning…

机器学习 · 计算机科学 2023-08-23 Amirhossein Reisizadeh , Khashayar Gatmiry , Asuman Ozdaglar

Here we show how the Minimally Entangled States (MES) of a 2d system with topological order can be identified using the geometric measure of entanglement. We show this by minimizing this measure for the doubled semion, doubled Fibonacci and…

强关联电子 · 物理学 2014-11-12 Oliver Buerschaper , Artur Garcia-Saez , Roman Orus , Tzu-Chieh Wei

Let $G$ be a $3$-connected ordered graph with $n$ vertices and $m$ edges. Let $\mathbf{p}$ be a randomly chosen mapping of these $n$ vertices to the integer range $\{1, 2,3, \ldots, 2^b\}$ for $b\ge m^2$. Let $\ell$ be the vector of $m$…

度量几何 · 数学 2024-06-27 Robert Connelly , Steven J. Gortler , Louis Theran

Channel interpolation is an essential technique for providing high-accuracy estimation of the channel state information (CSI) for wireless systems design where the frequency-space structural correlations of multi-antenna channel are…

信号处理 · 电气工程与系统科学 2019-05-21 Han Zhang , Bo Ai , Wenjun Xu , Li Xu , Shuguang Cui

The electrical property (EP) of human tissues is a quantitative biomarker that facilitates early diagnosis of cancerous tissues. Magnetic resonance electrical properties tomography (MREPT) is an imaging modality that reconstructs EPs by the…

医学物理 · 物理学 2022-05-27 Adan Jafet Garcia Inda , Shao Ying Huang , Nevrez İmamoğlu , Wenwei Yu

Infinite projected entangled-pair states (iPEPS) provide a powerful tensor network ansatz for two-dimensional quantum many-body systems in the thermodynamic limit. In this paper we introduce an approach to accurately compute the energy…

强关联电子 · 物理学 2025-12-01 Emilio Cortés Estay , Naushad A. Kamar , Philippe Corboz

Tensor hypercontraction is a method that allows the representation of a high-rank tensor as a product of lower-rank tensors. In this paper, we show how tensor hypercontraction can be applied to both the electron repulsion integral (ERI)…

Topology optimization can generate high-performance structures, but designers often need to revise the resulting topology in ways that reflect fabrication preferences, structural intuition, or downstream design constraints. In particular,…

图形学 · 计算机科学 2026-03-31 Hongrui Chen , Dat Quoc Ha , Josephine V. Carstensen , Faez Ahmed