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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…

化学物理 · 物理学 2019-07-10 Tim Gould , Stefano Pittalis

We present a family of multistep integrators based on the Adams-Bashforth methods. These schemes can be constructed for arbitrary convergence order with arbitrary step size variation. The step size can differ between different subdomains of…

数值分析 · 数学 2020-06-19 William Throwe , Saul A. Teukolsky

Meshless methods approximate operators in a specific node as a weighted sum of values in its neighbours. Higher order approximations of derivatives provide more accurate solutions with better convergence characteristics, but they come at…

分布式、并行与集群计算 · 计算机科学 2025-09-12 Jon Vehovar , Miha Rot , Gregor Kosec

New low-order $H(\textrm{div})$-conforming finite elements for symmetric tensors are constructed in arbitrary dimension. The space of shape functions is defined by enriching the symmetric quadratic polynomial space with the $(d+1)$-order…

数值分析 · 数学 2024-02-22 Xuehai Huang , Chao Zhang , Yaqian Zhou , Yangxing Zhu

In the scope of discrete finite-state models of interacting components, we present a novel algorithm for identifying sets of local states of components whose activity is necessary for the reachability of a given local state. If all the…

系统与控制 · 计算机科学 2013-07-15 Loïc Paulevé , Geoffroy Andrieux , Heinz Koeppl

Many protocols of quantum information processing use entangled states. Hence, separability criteria are of great importance. We propose new separability conditions for a bipartite finite-dimensional system. They are derived by using…

量子物理 · 物理学 2016-06-23 Alexey E. Rastegin

Transformation optics offers an unconventional approach to the control of electromagnetic fields. A transformation optical structure is designed by first applying a form-invariant coordinate transform to Maxwell's equations, in which part…

光学 · 物理学 2008-03-05 Marco Rahm , Steven A. Cummer , David Schurig , John B. Pendry , David R. Smith

A system (P_a: a in A) of probability measures on a common state space S indexed by another index set A can be ``realized'' by a system (X_a: a in A) of S-valued random variables on some probability space in such a way that each X_a is…

概率论 · 数学 2007-05-23 James Allen Fill , Motoya Machida

Efficient structural reanalysis for high-rank modification plays an important role in engineering computations which require repeated evaluations of structural responses, such as structural optimization and probabilistic analysis. To…

计算工程、金融与科学 · 计算机科学 2025-05-20 Wenxiong Li , Suiyin Chen , Huan Huang

For hybrid systems exhibiting periodic behavior, analyzing the invariant set containing the limit cycle is a natural way to study the robustness of the closed-loop system. However, computing these sets can be computationally expensive,…

系统与控制 · 电气工程与系统科学 2026-04-08 Varun Madabushi , Akash Harapanahalli , Samuel Coogan , Maegan Tucker

Estimating global properties of many-body quantum systems such as entropy or bipartite entanglement is a notoriously difficult task, typically requiring a number of measurements or classical post-processing resources growing exponentially…

A new additive and semidefinite programming (SDP) computable entanglement measure is introduced to upper bound the amount of distillable entanglement in bipartite quantum states by operations completely preserving the positivity of partial…

量子物理 · 物理学 2016-12-07 Xin Wang , Runyao Duan

Motivated by the Kronecker product approximation technique, we have developed a very simple method to assess the inseparability of bipartite quantum systems, which is based on a realigned matrix constructed from the density matrix. For any…

量子物理 · 物理学 2007-05-23 Kai Chen , Ling-An Wu

Tensor decomposition of high-dimensional data often struggles to capture semantically or physically meaningful structures, particularly when relying on reconstruction objectives and fixed-rank constraints. We introduce a no-rank tensor…

机器学习 · 计算机科学 2026-03-03 Maryam Bagherian

Based on the complementarity relation between entanglement of a composite system and the purity of a subsystem, we propose a simple method to measure the amount of entanglement. The method can be applied to a bipartite system in a pure…

量子物理 · 物理学 2008-12-19 Sang Min Lee , Hai-Woong Lee

In this work, we derive a multi-fragment real-time extension of projected density matrix embedding theory (pDMET) designed to treat non-equilibrium electron dynamics in strongly correlated systems. As in the previously developed static…

强关联电子 · 物理学 2023-04-19 Dariia Yehorova , Joshua S. Kretchmer

Feedforward neural networks are widely used in autonomous systems, particularly for control and perception tasks within the system loop. However, their vulnerability to adversarial attacks necessitates formal verification before deployment…

最优化与控制 · 数学 2025-09-03 Yuhao Zhang , Xiangru Xu

In this paper a constructive method to determine and compute probabilistic reachable and invariant sets for linear discrete-time systems, excited by a stochastic disturbance, is presented. The samples of the disturbance signal are not…

系统与控制 · 电气工程与系统科学 2020-04-16 Mirko Fiacchini , Teodoro Alamo

Density functional theory (DFT) embedding provides a formally exact framework for interfacing correlated wave-function theory (WFT) methods with lower-level descriptions of electronic structure. Here, we report techniques to improve the…

化学物理 · 物理学 2015-06-12 Jason D. Goodpaster , Taylor A. Barnes , Frederick R. Manby , Thomas F. Miller

A hybrid quantum system consisting of spatially separated two-level atoms is studied. Two atoms do not interact directly, but they are coupled via an intermediate system which is consisting of a superconducting flux qubit interacting with a…

量子物理 · 物理学 2019-06-13 Elaheh Afsaneh , Malek Bagheri Harouni , Marjan Jafari
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