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Related papers: Cluster expansion methods from physical concepts

200 papers

The paper considers the problem of anomaly detection in 3D images of fibre materials. The spatial Stochastic Expectation Maximisation algorithm and Adaptive Weights Clustering are applied to solve this problem. The initial 3D grey scale…

We consider the sampling of the coupled cluster expansion within stochastic coupled cluster theory. Observing the limitations of previous approaches due to the inherently non-linear behaviour of a coupled cluster wavefunction representation…

Chemical Physics · Physics 2018-08-14 Charles J. C. Scott , Alex J. W. Thom

The Coupled-Cluster theory is one of the most successful high precision methods used to solve the stationary Schr\"odinger equation. In this article, we address the mathematical foundation of this theory with focus on the advances made in…

Chemical Physics · Physics 2019-09-04 Andre Laestadius , Fabian M. Faulstich

Data clustering is the process of identifying natural groupings or clusters within multidimensional data based on some similarity measure. Clustering is a fundamental process in many different disciplines. Hence, researchers from different…

Machine Learning · Computer Science 2014-08-26 Sibei Yang , Liangde Tao , Bingchen Gong

The aim of this paper is to give a short review on cluster dynamics modeling in the field of atoms and point defects clustering in materials. It is shown that this method, due to its low computer cost, can handle long term evolution that…

Materials Science · Physics 2007-09-13 Alain Barbu , Emmanuel Clouet

We introduce a formalism based on a combinatorial notion of cell complex subject to an inclusion-reversing duality operation. Our main goal is to open the way for a functorial definition of field theories in a context where no manifold or…

Mathematical Physics · Physics 2022-04-15 Maxime Savoy

While colloids are promising building blocks for the self-assembly of materials with novel microstructures, their numerous tunable parameters inhibit brute force searching for appropriate parameter combinations that yield self-assembly of a…

Soft Condensed Matter · Physics 2020-03-13 Beth A Lindquist

Most generative models for clustering implicitly assume that the number of data points in each cluster grows linearly with the total number of data points. Finite mixture models, Dirichlet process mixture models, and Pitman--Yor process…

We propose a model-based clustering algorithm for a general class of functional data for which the components could be curves or images. The random functional data realizations could be measured with error at discrete, and possibly random,…

Machine Learning · Statistics 2022-03-14 Steven Golovkine , Nicolas Klutchnikoff , Valentin Patilea

It is known that the spatial product of two product systems is intrinsic. Here we extend this result by analyzing subsystems of the tensor product of product systems. A relation with cluster systems is established. In a special case, we…

Functional Analysis · Mathematics 2015-02-12 Mithun Mukherjee

Clustering is one of the main tasks in exploratory data analysis and descriptive statistics where the main objective is partitioning observations in groups. Clustering has a broad range of application in varied domains like climate,…

Databases · Computer Science 2012-03-20 Saptarsi Goswami , Amlan Chakrabarti

Cluster analysis methods seek to partition a data set into homogeneous subgroups. It is useful in a wide variety of applications, including document processing and modern genetics. Conventional clustering methods are unsupervised, meaning…

Methodology · Statistics 2014-07-11 Eric Bair

Inspired by the ideas and techniques used in the study of cluster algebras we construct a new class of algebras, called bistellar cluster algebras, from closed oriented triangulated even-dimensional manifolds by performing…

Algebraic Topology · Mathematics 2024-05-16 Alastair Darby , Fang Li , Zhi Lu

We develop a simple and unified approach to investigate several aspects of the cluster statistics of random expansive (multi-)sets. In particular, we determine the limiting distribution of the size of the smallest and largest clusters, we…

Probability · Mathematics 2022-08-02 Konstantinos Panagiotou , Leon Ramzews

In this paper, we address an issue of finding explainable clusters of class-uniform data in labelled datasets. The issue falls into the domain of interpretable supervised clustering. Unlike traditional clustering, supervised clustering aims…

Machine Learning · Computer Science 2023-07-18 Natallia Kokash , Leonid Makhnist

Clustering provides a common means of identifying structure in complex data, and there is renewed interest in clustering as a tool for the analysis of large data sets in many fields. A natural question is how many clusters are appropriate…

Data Analysis, Statistics and Probability · Physics 2007-05-23 Susanne Still , William Bialek

Clustering is often used for discovering structure in data. Clustering systems differ in the objective function used to evaluate clustering quality and the control strategy used to search the space of clusterings. Ideally, the search…

Artificial Intelligence · Computer Science 2014-11-17 D. Fisher

We introduce a new clustering method for the classification of functional data sets by their probabilistic law, that is, a procedure that aims to assign data sets to the same cluster if and only if the data were generated with the same…

Methodology · Statistics 2023-12-29 Antonio Galves , Fernando Najman , Marcela Svarc , Claudia D. Vargas

Finite temperature disordered solid solutions and magnetic materials are difficult to study directly using first principles calculations, due to the large unit cells and many independent samples that are required. In this work, we develop a…

Materials Science · Physics 2019-05-22 Kevin F. Garrity

A general framework for dealing with both linear regression and clustering problems is described. It includes Gaussian clusterwise linear regression analysis with random covariates and cluster analysis via Gaussian mixture models with…

Methodology · Statistics 2015-10-13 Giuliano Galimberti , Annamaria Manisi , Gabriele Soffritti