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A Simple Framework of Conservative Algorithms for the Coupled Nonlinear Schrdinger Equations with Multiply Components

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Communications in Theoretical Physics 2014年第6期61卷 703-709页

作者：钱旭宋松和李伟斌 Department of Mathematics and Systems Science National University of Defense Technology Program in Applied and Computational Mathematics Princeton University State Key Laboratory of High Performance Computing National University of Defense Technology

Considering the coupled nonlinear Schr¨odinger system with multiply components, we provide a novel framework for constructing energy-preserving algorithms. In detail, based on the high order compact finite difference method, Fourier pseudospectral method and wavelet collocation method for spatial discretizations, a series of high accurate conservative algorithms are presented. The proposed algorithms can preserve the corresponding discrete charge and energy conservation laws exactly, which would guarantee their numerical stabilities during long time ***, several analogous multi-symplectic algorithms are constructed as comparison. Numerical experiments for the unstable plane waves will show the advantages of the proposed algorithms over long time and verify the theoretical analysis.

关键词： conservative algorithm coupled nonlinear SchrSdinger equation multiply components unstablewave

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Absolute change pivot rule for the simplex algorithm

Absolute change pivot rule for the simplex algorithm

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International MultiConference of Engineers and Computer Scientists, IMECS 2014

作者： Chankong, Kittiphong Intiyot, Boonyarit Sinapiromsaran, Krung Applied Mathematics and Computational Science Program Department of Mathematics and Computer Science Faculty of Science Chulalongkorn University Bangkok Thailand

ISBN: (纸本)9789881925336

The simplex algorithm is a widely used method for solving a linear programming problem (LP) which is first presented by George B. Dantzig. One of the important steps of the simplex algorithm is applying an appropriate pivot rule, the rule to select the entering variable. An effective pivot rule can lead to the optimal solution of LP with the small number of iterations. In a minimization problem, Dantzig's pivot rule selects an entering variable corresponding to the most negative reduced cost. The concept is to have the maximum improvement in the objective value per unit step of the entering variable. However, in some problems, Dantzig's rule may visit a large number of extreme points before reaching the optimal solution. In this paper, we propose a pivot rule that could reduce the number of such iterations over the Dantzig's pivot rule. The idea is to have the maximum improvement in the objective value function by trying to block a leaving variable that makes a little change in the objective function value as much as possible. Then we test and compare the efficacy of this rule with Dantzig' original rule.

关键词： Linear programming

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Stylistic analysis of paintings using wavelets and machine learning

Stylistic analysis of paintings using wavelets and machine l...

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17th European Signal Processing Conference, EUSIPCO 2009

作者： Jafarpour, Sina Polatkan, Güngör Brevdo, Eugene Hughes, Shannon Brasoveanu, Andrei Daubechies, Ingrid Princeton University Departments of Electrical Engineering Computer Science and Mathematics Program in Applied and Computational Mathematics Princeton NJ 08544 United States

Wavelet transforms and machine learning tools can be used to assist art experts in the stylistic analysis of paintings. A dual-tree complex wavelet transform, Hidden Markov Tree modeling and Random Forest classifiers are used here for a stylistic analysis of Vincent van Gogh's paintings with results on two stylometry challenges that concern "dating, resp. extracting distinguishing features". © EURASIP, 2009.

关键词： Decision trees

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Anomalous suppression of large-scale density fluctuations in classical and quantum spin liquids

arXiv

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arXiv 2025年

作者： Chen, Duyu Samajdar, Rhine Jiao, Yang Torquato, Salvatore Materials Research Laboratory University of California Santa BarbaraCA93106 United States Department of Physics Princeton University PrincetonNJ08544 United States Princeton Center for Theoretical Science Princeton University PrincetonNJ08544 United States Materials Science and Engineering Arizona State University TempeAZ85287 United States Department of Physics Arizona State University TempeAZ85287 United States Department of Chemistry Princeton University PrincetonNJ08544 United States Princeton Materials Institute Princeton University PrincetonNJ08540 United States Program in Applied and Computational Mathematics PrincetonNJ08544 United States

Classical spin liquids (CSLs) are intriguing states of matter that do not exhibit long-range magnetic order and are characterized by an extensive ground-state degeneracy. Adding quantum fluctuations, which induce dynamics between these different classical ground states, can give rise to quantum spin liquids (QSLs). QSLs are highly entangled quantum phases of matter characterized by fascinating emergent properties, such as fractionalized excitations and topological order. One such exotic quantum liquid is the Z2 QSL, which can be regarded as a resonating valence bond (RVB) state formed from superpositions of dimer coverings of an underlying lattice. In this work, we unveil a hidden large-scale structural property of archetypal CSLs and QSLs known as hyperuniformity, i.e., normalized infinite-wavelength density fluctuations are completely suppressed in these systems. In particular, we first demonstrate that classical ensembles of close-packed dimers and their corresponding quantum RVB states are perfectly hyperuniform in general. Subsequently, we focus on a ruby-lattice spin liquid that was recently realized in a Rydberg-atom quantum simulator, and show that the QSL remains effectively hyperuniform even in the presence of a finite density of spinon and vison excitations, as long as the dimer constraint is still largely preserved. Moreover, we demonstrate that metrics based on the framework of hyperuniformity can be used to distinguish the QSL from other proximate quantum phases. These metrics can help identify potential QSL candidates, which can then be further analyzed using more advanced, computationally-intensive quantum numerics to confirm their status as true QSLs. © 2025, CC BY-NC-ND.

关键词： Quantum entanglement

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NUMERICAL STUDY OF A 2-POINT CORRELATION-FUNCTION AND LIOUVILLE FIELD PROPERTIES IN 2-DIMENSIONAL QUANTUM-GRAVITY

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MODERN PHYSICS LETTERS A 1991年第12期6卷 1115-1131页

作者： AGISHTEIN, ME BENAV, R MIGDAL, AA SOLOMON, S Program in Applied and Computational Mathematics Fine Hall Princeton University Princeton NJ 08544–1000 USA Nuclear Physics Department Weizmann Institute of Science Rehovot 76100 Israel Physics Department and Program in Applied and Computational Mathematics Fine Hall Princeton University Princeton NJ 08544–1000 USA Physics Department Hebrew University Jerusalem Israel

Two-point Green's function is measured on the manifolds of a 2-dimensional quantum gravity. The recursive sampling technique is used to generate the triangulations, lattice sizes being up to hundred thousand triangles. The grid Laplacian was inverted by means of the algebraic multi-grid solver. The free field model of the Quantum Gravity assumes the Gaussian behavior of Liouville field and curvature. We measured histograms as well as six momenta of these fields. Our results support the Gaussian assumption.

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GAUGE METHOD FOR VISCOUS INCOMPRESSIBLE FLOWS

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Communications in Mathematical sciences 2003年第2期1卷 317-332页

作者： Weinan, E. Liu, Jian-Guo Department of Mathematics and Program in Applied and Computational Mathematics Princeton University Princeton 08544 NJ United States Institute for Physical Science and Technology and Department of Mathematics University of Maryland College Park 20742 MD United States

We present a new formulation of the incompressible Navier-Stokes equation in terms of an auxiliary field that differs from the velocity by a gauge transformation. The gauge freedom allows us to assign simple and specific boundary conditions for both the auxiliary field and the gauge field, thus eliminating the issue of pressure boundary condition in the usual primitive variable formulation. The resulting dynamic and kinematic equations can then be solved by standard methods for heat and Poisson equations. A normal mode analysis suggests that in contrast to the classical projection method, the gauge method does not suffer from the problem of numerical boundary layers. Thus the subtleties in the spatial discretization for the projection method are removed. Consequently, the projection step in the gauge method can be accomplished by standard Poisson solves. We demonstrate the efficiency and accuracy of the gauge method by several numerical examples, including the flow past cylinder © 2003 International Press

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An Iterative Thresholding Method for the Minimum Compliance Problem

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Communications in computational Physics 2023年第4期33卷 1189-1216页

作者： Luyu Cen Wei Hu Dong Wang Xiaoping Wang Department of Mathematics Hong Kong University of Science and TechnologyClear Water BayKowloonHong KongChina The Program in Applied and Computational Mathematics Princeton UniversityPrincetonNew JerseyUSA School of Science and Engineering The Chinese University of Hong KongShenzhenGuangdong 518172China Shenzhen International Center for Industrial and Applied Mathematics Shenzhen Research Institute of Big DataGuangdong 518172China

In this paper,we propose a simple energy decaying iterative thresholding algorithm to solve the two-phase minimum compliance *** material domain is implicitly represented by its characteristic function,and the problem is formulated into a minimization problem by the principle of minimum complementary *** prove that the energy is decreasing in each *** effective continuation schemes are proposed to avoid trapping into the local *** results on 2D isotropic linear material demonstrate the effectiveness of the proposed methods.

关键词： Minimum compliance convolution thresholding linear elasticity

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DeePKS + ABACUS as a Bridge between Expensive Quantum Mechanical Models and Machine Learning Potentials

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Journal of Physical Chemistry A 2022年第49期126卷 9154-9164页

作者： Li, Wenfei Ou, Qi Chen, Yixiao Cao, Yu Liu, Renxi Zhang, Chunyi Zheng, Daye Cai, Chun Wu, Xifan Wang, Han Chen, Mohan Zhang, Linfeng AI for Science Institute Beijing100080 China Program in Applied and Computational Mathematics Princeton University PrincetonNJ08544 United States HEDPS CAPT College of Engineering School of Physics Peking University Beijing100871 China Department of Physics Temple University PhiladelphiaPA19122 United States Laboratory of Computational Physics Institute of Applied Physics and Computational Mathematics Huayuan Road 6 Beijing100088 China DP Technology Beijing100080 China

Recently, the development of machine learning (ML) potentials has made it possible to perform large-scale and long-time molecular simulations with the accuracy of quantum mechanical (QM) models. However, for different levels of QM methods, such as density functional theory (DFT) at the meta-GGA level and/or with exact exchange, quantum Monte Carlo, etc., generating a sufficient amount of data for training an ML potential has remained computationally challenging due to their high cost. In this work, we demonstrate that this issue can be largely alleviated with Deep Kohn-Sham (DeePKS), an ML-based DFT model. DeePKS employs a computationally efficient neural network-based functional model to construct a correction term added upon a cheap DFT model. Upon training, DeePKS offers closely matched energies and forces compared with high-level QM method, but the number of training data required is orders of magnitude less than that required for training a reliable ML potential. As such, DeePKS can serve as a bridge between expensive QM models and ML potentials: one can generate a decent amount of high-accuracy QM data to train a DeePKS model and then use the DeePKS model to label a much larger amount of configurations to train an ML potential. This scheme for periodic systems is implemented in a DFT package ABACUS, which is open source and ready for use in various applications. © 2022 The Journal of Physical Chemistry A. All right reserved.

关键词： Density functional theory

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Noisy Hegselmann-Krause systems: Phase transition and the 2R-conjecture 55

Noisy Hegselmann-Krause systems: Phase transition and the 2R...

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55th IEEE Conference on Decision and Control, CDC 2016

作者： Wang, Chu Li, Qianxiao Weinan, E. Chazelle, Bernard Program in Applied and Computational Mathematics Princeton University PrincetonNJ08540 United States Nokia Bell Labs 600 Mountain Avenue Murray HillNJ07974 United States Department of Mathematics Program in Applied and Computational Mathematics Princeton University NJ08540 United States Department of Computer Science Princeton University PrincetonNJ08540 United States

ISBN: (纸本)9781509018376

The classic Hegselmann-Krause (HK) model for opinion dynamics consists of a set of agents on the real line, each one instructed to move, at every time step, to the mass center of the agents within a fixed distance R. In this work, we investigate the effects of noise in the continuous-time version of the model as described by its mean-field Fokker-Planck equation. In the presence of a finite number of agents, the system exhibits a phase transition from order to disorder as the noise increases. We introduce an order parameter to track the phase transition and resolve the corresponding phase diagram. The system undergoes a phase transition for small R but none for larger R. Based on the stability analysis of the mean-field equation, we derive the existence of a forbidden zone for the disordered phase to emerge. We also provide a theoretical explanation for the well-known 2R conjecture, which states that, for a random initial distribution in a fixed interval, the final configuration consists of clusters separated by a distance of roughly 2R. Our theoretical analysis confirms previous simulations and predicts properties of the noisy HK model in higher dimension. © 2016 IEEE.

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Dynamical properties of particulate composites derived from ultradense stealthy hyperuniform sphere packings

arXiv

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arXiv 2025年

作者： Vanoni, Carlo Kim, Jaeuk Steinhardt, Paul J. Torquato, Salvatore Department of Physics Princeton University PrincetonNJ08544 United States Department of Chemistry Princeton University PrincetonNJ08544 United States Princeton Institute for the Science and Technology of Materials Princeton University PrincetonNJ08544 United States Program in Applied and Computational Mathematics Princeton University PrincetonNJ08544 United States

Stealthy hyperuniform (SHU) many-particle systems are distinguished by a structure factor that vanishes not only at zero wavenumber (as in "standard" hyperuniform systems) but also across an extended range of wavenumbers near the origin. We generate disordered SHU packings of identical and ‘nonoverlapping’ spheres in d-dimensional Euclidean space using a modified collective-coordinate optimization algorithm that incorporates a soft-core repulsive potential between particles in addition to the standard stealthy pair potential. Compared to SHU packings without soft-core repulsions, these SHU packings are ultradense with packing fractions ranging from 0.67-0.86 for d = 2 and 0.47-0.63 for d = 3, spanning a broad spectrum of structures depending on the stealthiness parameter χ. We consider two-phase media composed of hard particles derived from ultradense SHU packings (phase 2) embedded in a matrix phase (phase 1), with varying stealthiness parameter χ and packing fractions . Our main objective is the estimation of the dynamical physical properties of such two-phase media, namely, the effective dynamic dielectric constant and the time-dependent diffusion spreadability, which is directly related to nuclear magnetic relaxation in fluid-saturated porous media. We show through spreadability that two-phase media derived from ultradense SHU packings exhibit faster interphase diffusion due to the higher packing fractions achievable compared to media obtained without soft-core repulsion. The imaginary part of the effective dynamic dielectric constant of SHU packings vanishes at a small wavenumber, implying perfect transparency for the corresponding wavevectors. While a larger packing fraction yields a smaller transparency interval, we show that it also displays a reduced height of the attenuation peak. We also obtain cross-property relations between transparency characteristics and long-time behavior of the spreadability for such two-phase media, showing that one leads to infor

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