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We show how graph theory can be combined with quantum theory to calculate the electronic structure of large complex systems. The graph formalism is general and applicable to a broad range of electronic structure methods and materials,…

We study the problem of embedding graphs in the plane as good geometric spanners. That is, for a graph $G$, the goal is to construct a straight-line drawing $\Gamma$ of $G$ in the plane such that, for any two vertices $u$ and $v$ of $G$,…

Data Structures and Algorithms · Computer Science 2020-02-14 Oswin Aichholzer , Manuel Borrazzo , Prosenjit Bose , Jean Cardinal , Fabrizio Frati , Pat Morin , Birgit Vogtenhuber

We study the Laplacian on family preserving metric graphs. These are graphs that have a certain symmetry that, as we show, allows for a decomposition into a direct sum of one-dimensional operators whose properties are explicitly related to…

Spectral Theory · Mathematics 2020-02-19 Jonathan Breuer , Netanel Levi

An elastic graph is a graph with an elasticity associated to each edge. It may be viewed as a network made out of ideal rubber bands. If the rubber bands are stretched on a target space there is an elastic energy. We characterize when a…

Metric Geometry · Mathematics 2020-02-12 Dylan P. Thurston

The pseudo-inverse of a graph Laplacian matrix, denoted as $L^\dagger$, finds extensive application in various graph analysis tasks. Notable examples include the calculation of electrical closeness centrality, determination of Kemeny's…

Data Structures and Algorithms · Computer Science 2023-11-20 Meihao Liao , Rong-Hua Li , Qiangqiang Dai , Hongyang Chen , Guoren Wang

Statistical graph models aim at modeling graphs as random realization among a set of possible graphs. One issue is to evaluate whether or not a graph is likely to have been generated by one particular model. In this paper we introduce the…

Social and Information Networks · Computer Science 2022-03-29 Louis Duvivier , Rémy Cazabet , Céline Robardet

This work explores the definiteness of the weighted graph Laplacian matrix with negative edge weights. The definiteness of the weighted Laplacian is studied in terms of certain matrices that are related via congruent and similarity…

Optimization and Control · Mathematics 2015-03-03 Daniel Zelazo , Mathias Bürger

The $\lambda$-core vertices of a graph correspond to the non-zero entries of some eigenvector of $\lambda$ for a universal adjacency matrix $\mathbf{U}$ of the graph. We define a partition of the vertex set $V$ based on the $\lambda$-core…

Combinatorics · Mathematics 2021-03-02 Xandru Mifsud

In this work we introduce a concept of complexity for undirected graphs in terms of the spectral analysis of the Laplacian operator defined by the incidence matrix of the graph. Precisely, we compute the norm of the vector of eigenvalues of…

Information Theory · Computer Science 2022-03-23 Diego M. Mateos , Federico Morana , Hugo Aimar

In this paper we investigate the controllability and observability properties of a family of linear dynamical systems, whose structure is induced by the Laplacian of a grid graph. This analysis is motivated by several applications in…

Optimization and Control · Mathematics 2012-03-02 Giuseppe Notarstefano , Gianfranco Parlangeli

We introduce and study Laplacians on a finite metric graph endowed with generalized densities, that is, measures of finite mass. One important motivation is that this setting provides a common framework for several interesting classes of…

Spectral Theory · Mathematics 2025-12-24 Kiyan Naderi , Noema Nicolussi

The toughness $t(G)$ of a graph $G=(V,E)$ is defined as $t(G)=\min\{\frac{|S|}{c(G-S)}\}$, in which the minimum is taken over all $S\subset V$ such that $G-S$ is disconnected, where $c(G-S)$ denotes the number of components of $G-S$. We…

Combinatorics · Mathematics 2021-04-09 Xiaofeng Gu , Willem H. Haemers

Graph embeddings, a class of dimensionality reduction techniques designed for relational data, have proven useful in exploring and modeling network structure. Most dimensionality reduction methods allow out-of-sample extensions, by which an…

Machine Learning · Statistics 2019-10-02 Keith Levin , Fred Roosta , Minh Tang , Michael W. Mahoney , Carey E. Priebe

This paper concerns the large deviations of a system of interacting particles on a random graph. There is no stochasticity, and the only sources of disorder are the random graph connections, and the initial condition. The average number of…

Probability · Mathematics 2021-03-08 James MacLaurin

We study the problem of detecting the presence of an underlying high-dimensional geometric structure in a random graph. Under the null hypothesis, the observed graph is a realization of an Erd\H{o}s-R\'enyi random graph $G(n,p)$. Under the…

Statistics Theory · Mathematics 2015-11-24 Sébastien Bubeck , Jian Ding , Ronen Eldan , Miklós Rácz

We consider a new problem of designing a network with small $s$-$t$ effective resistance. In this problem, we are given an undirected graph $G=(V,E)$, two designated vertices $s,t \in V$, and a budget $k$. The goal is to choose a subgraph…

Data Structures and Algorithms · Computer Science 2019-04-09 Pak Hay Chan , Lap Chi Lau , Aaron Schild , Sam Chiu-wai Wong , Hong Zhou

Graph connectivity is a fundamental combinatorial optimization problem that arises in many practical applications, where usually a spanning subgraph of a network is used for its operation. However, in the real world, links may fail…

Data Structures and Algorithms · Computer Science 2022-09-13 Dimitris Fotakis , Evangelia Gergatsouli , Charilaos Pipis , Miltiadis Stouras , Christos Tzamos

An important challenge in the field of exponential random graphs (ERGs) is the fitting of non-trivial ERGs on large graphs. By utilizing fast matrix block-approximation techniques, we propose an approximative framework to such non-trivial…

Social and Information Networks · Computer Science 2022-02-02 Florian Adriaens , Alexandru Mara , Jefrey Lijffijt , Tijl De Bie

The efficiency of graph-based semi-supervised algorithms depends on the graph of instances on which they are applied. The instances are often in a vectorial form before a graph linking them is built. The construction of the graph relies on…

Machine Learning · Computer Science 2016-02-19 Pauline Wauquier , Mikaela Keller

A basic fact in spectral graph theory is that the number of connected components in an undirected graph is equal to the multiplicity of the eigenvalue zero in the Laplacian matrix of the graph. In particular, the graph is disconnected if…

Metric Geometry · Mathematics 2014-11-24 James R. Lee , Shayan Oveis Gharan , Luca Trevisan