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We demonstrate the utility of an unsupervised machine learning tool for the detection of phase transitions in off-lattice systems. We focus on the application of principal component analysis (PCA) to detect the freezing transitions of…

计算物理 · 物理学 2018-12-07 R. B. Jadrich , B. A. Lindquist , T. M. Truskett

We perform a principal component analysis (PCA) of two one-dimensional lattice models belonging to distinct nonequilibrium universality classes - directed bond percolation and branching and annihilating random walks with even number of…

We apply unsupervised machine learning techniques, mainly principal component analysis (PCA), to compare and contrast the phase behavior and phase transitions in several classical spin models - the square and triangular-lattice Ising…

统计力学 · 物理学 2017-06-23 Wenjian Hu , Rajiv R. P. Singh , Richard T. Scalettar

In this work we apply the principal component analysis (PCA) method with kernel trick to study classification of phases and phase transition in classical XY models in frustrated lattices. Comparing to our previous work with linear PCA…

统计力学 · 物理学 2018-06-26 Ce Wang , Hui Zhai

In recent years, Artificial Intelligence techniques have proved to be very successful when applied to problems in physical sciences. Here we apply an unsupervised Machine Learning (ML) algorithm called Principal Component Analysis (PCA) as…

We apply various unsupervised machine learning methods for phase classification to investigate the finite-temperature phase diagram of the spinless Falicov-Kimball model in two dimensions. Using only particle occupation snapshots from Monte…

强关联电子 · 物理学 2025-05-27 Lukáš Frk , Pavel Baláž , Elguja Archemashvili , Martin Žonda

Principal component analysis (PCA) is often used for analyzing data in the most diverse areas. In this work, we report an integrated approach to several theoretical and practical aspects of PCA. We start by providing, in an intuitive and…

计算工程、金融与科学 · 计算机科学 2021-06-09 Felipe L. Gewers , Gustavo R. Ferreira , Henrique F. de Arruda , Filipi N. Silva , Cesar H. Comin , Diego R. Amancio , Luciano da F. Costa

Principal component analysis (PCA) is a widespread technique for data analysis that relies on the covariance-correlation matrix of the analyzed data. However to properly work with high-dimensional data, PCA poses severe mathematical…

定量方法 · 定量生物学 2018-10-18 Luigi Leonardo Palese

Principal component analysis (PCA) aims at estimating the direction of maximal variability of a high-dimensional dataset. A natural question is: does this task become easier, and estimation more accurate, when we exploit additional…

信息论 · 计算机科学 2014-06-19 Andrea Montanari , Emile Richard

Principal component analysis (PCA) represents a standard approach to identify collective variables $\{x_i\}\!=\!\boldsymbol{x}$, which can be used to construct the free energy landscape $\Delta G(\boldsymbol{x})$ of a molecular system.…

生物大分子 · 定量生物学 2019-05-30 Matthias Post , Steffen Wolf , Gerhard Stock

We explore the physical implications of applying principal component analysis (PCA) to translationally invariant classical systems defined on a $d$-dimensional hypercubic lattice. Using Rayleigh-Schr\"odinger perturbation theory, we…

统计力学 · 物理学 2025-04-08 Su-Chan Park

Vortices in type-II superconductors driven over random disorder are known to exhibit a remarkable variety of distinct nonequilibrium dynamical phases that arise due to the competition between vortex-vortex interactions, the quenched…

超导电性 · 物理学 2025-01-24 C. J. O. Reichhardt , D. McDermott , C. Reichhardt

We present quasicyclic principal component analysis (QPCA), a generalization of principal component analysis (PCA), that determines an optimized basis for a dataset in terms of families of shift-orthogonal principal vectors. This is of…

数值分析 · 数学 2025-02-11 Susanna E. Rumsey , Stark C. Draper , Frank R. Kschischang

Frustration driven quantum fluctuation leads to many exotic phases in the ground state and study of these quantum phase transitions is one of the most challenging areas of research in condensed matter physics. Here, a frustrated Heisenberg…

强关联电子 · 物理学 2022-02-02 Sk Saniur Rahaman , Sumit Haldar , Manoranjan Kumar

Principal Component Analysis (PCA) is a ubiquitous tool with many applications in machine learning including feature construction, subspace embedding, and outlier detection. In this paper, we present an algorithm for computing the top…

机器学习 · 计算机科学 2013-10-25 Nikos Karampatziakis , Paul Mineiro

Principal component analysis (PCA) is a powerful method that can identify patterns in large, complex data sets by constructing low-dimensional order parameters from higher-dimensional feature vectors. There are increasing efforts to use…

介观与纳米尺度物理 · 物理学 2025-11-03 C. J. O. Reichhardt , D. McDermott , C. Reichhardt

Principal component analysis (PCA) is a dimensionality reduction method in data analysis that involves diagonalizing the covariance matrix of the dataset. Recently, quantum algorithms have been formulated for PCA based on diagonalizing a…

量子物理 · 物理学 2022-10-26 Max Hunter Gordon , M. Cerezo , Lukasz Cincio , Patrick J. Coles

Principal Component Analysis (PCA) is a method for estimating a subspace given noisy samples. It is useful in a variety of problems ranging from dimensionality reduction to anomaly detection and the visualization of high dimensional data.…

统计理论 · 数学 2019-06-14 David Hong , Laura Balzano , Jeffrey A. Fessler

Principal component analysis (PCA) is largely adopted for chemical process monitoring and numerous PCA-based systems have been developed to solve various fault detection and diagnosis problems. Since PCA-based methods assume that the…

机器学习 · 计算机科学 2017-12-13 Haitao Zhao

It is shown that Principal Component Analysis (PCA) applied to event-by-event single-particle distributions in A-A collisions allows establishing the most optimal basis for anisotropic flow studies from data itself, in contrast to manual…

核理论 · 物理学 2020-12-01 Igor Altsybeev
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