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High-throughput computational materials searches generate large databases of locally-stable structures. Conventionally, the needle-in-a-haystack search for the few experimentally-synthesizable compounds is performed using a convex hull…

Materials Science · Physics 2018-10-24 Andrea Anelli , Edgar A. Engel , Chris J. Pickard , Michele Ceriotti

Convex clustering is a well-regarded clustering method, resembling the similar centroid-based approach of Lloyd's $k$-means, without requiring a predefined cluster count. It starts with each data point as its centroid and iteratively merges…

Machine Learning · Statistics 2026-05-15 Shubhayan Pan , Kushal Bose , Debolina Paul , Saptarshi Chakraborty , Swagatam Das

We propose a neural parameterization of convex sets by learning sublinear (positively homogeneous and convex) functions. Our networks implicitly represent both the support and gauge functions of a convex body. We prove a universal…

Optimization and Control · Mathematics 2026-05-06 Eloi Martinet

A quadratically constrained quadratic program (QCQP) is an optimization problem in which the objective function is a quadratic function and the feasible region is defined by quadratic constraints. Solving non-convex QCQP to global…

Optimization and Control · Mathematics 2018-12-27 Asteroide Santana , Santanu S. Dey

We develop techniques to convexify a set that is invariant under permutation and/or change of sign of variables and discuss applications of these results. First, we convexify the intersection of the unit ball of a permutation and…

Optimization and Control · Mathematics 2021-08-10 Jinhak Kim , Mohit Tawarmalani , Jean-Philippe P. Richard

We study sets defined as the intersection of a rank-1 constraint with different choices of linear side constraints. We identify different conditions on the linear side constraints, under which the convex hull of the rank-1 set is polyhedral…

Optimization and Control · Mathematics 2019-09-20 Santanu S. Dey , Burak Kocuk , Asteroide Santana

Computationally efficient and automated generation of convex hulls is desirable for high throughput materials discovery of thermodynamically stable multi-species crystal structures. A convex hull genetic algorithm is proposed that uses…

Materials Science · Physics 2024-04-23 Scott Donaldson , Robert A. Lawrence , Matt I. J. Probert

For a planar point set $P$, its convex hull is the smallest convex polygon that encloses all points in $P$. The construction of the convex hull from an array $I_P$ containing $P$ is a fundamental problem in computational geometry. By…

Computational Geometry · Computer Science 2025-06-30 Ivor van der Hoog , Eva Rotenberg , Daniel Rutschmann

Using feature attributions for post-hoc explanations is a common practice to understand and verify the predictions of opaque machine learning models. Despite the numerous techniques available, individual methods often produce inconsistent…

Machine Learning · Computer Science 2024-06-10 Thomas Decker , Ananta R. Bhattarai , Jindong Gu , Volker Tresp , Florian Buettner

The convex hull describes the extent or shape of a set of data and is used ubiquitously in computational geometry. Common algorithms to construct the convex hull on a finite set of n points (x,y) range from O(nlogn) time to O(n) time.…

Computational Geometry · Computer Science 2015-05-06 José O. Cadenas , Graham Megson

In order to express a polyhedron as the (Minkowski) sum of a polytope and a polyhedral cone, Motzkin (1936) made a transition from the polyhedron to a polyhedral cone. Based on his excellent idea, we represent a set by a characteristic…

Optimization and Control · Mathematics 2015-04-01 Mahmood Mehdiloozad , Kaoru Tone , Rahim Askarpour , Mohammad Bagher Ahmadi

This paper gives two different proofs to a structural theorem of decreasing minimization (lexicographic optimization) on integrally convex sets. The theorem states that the set of decreasingly minimal elements of an integrally convex set…

Optimization and Control · Mathematics 2025-04-28 Kazuo Murota , Akihisa Tamura

We derive a closed form description of the convex hull of mixed-integer bilinear covering set with bounds on the integer variables. This convex hull description is determined by considering some orthogonal disjunctive sets defined in a…

Optimization and Control · Mathematics 2019-03-05 Hamidur Rahman , Ashutosh Mahajan

Seeking the convex hull of an object is a very fundamental problem arising from various tasks. In this work, we propose two variational convex hull models using level set representation for 2-dimensional data. The first one is an exact…

Computer Vision and Pattern Recognition · Computer Science 2019-08-12 Lingfeng Li , Shousheng Luo , Xue-Cheng Tai , Jiang Yang

A convex geometry is a closure system satisfying the anti-exchange property. This paper, following the work of K. Adaricheva and M. Bolat (2016) and the Polymath REU 2020 team, continues to investigate representations of convex geometries…

Combinatorics · Mathematics 2022-06-14 Kira Adaricheva , Evan Daisy , Ayush Garg , Zachary King , Grace Ma , Michelle Olson , Cat Raanes , James Thompson

In this work, we present a new efficient method for convex shape representation, which is regardless of the dimension of the concerned objects, using level-set approaches. Convexity prior is very useful for object completion in computer…

Computer Vision and Pattern Recognition · Computer Science 2020-03-24 Lingfeng li , Shousheng Luo , Xue-Cheng Tai , Jiang Yang

This paper presents several strategies to tune the parameters of metaheuristic methods for (discrete) design optimization of reinforced concrete (RC) structures. A novel utility metric is proposed, based on the area under the average…

Neural and Evolutionary Computing · Computer Science 2021-10-13 Iván Negrin , Dirk Roose , Ernesto Chagoyén

In this paper, we study the set $\mathcal{S}^\kappa = \{ (x,y)\in\mathcal{G}\times\mathbb{R}^n : y_j = x_j^\kappa , j=1,\dots,n\}$, where $\kappa > 1$ and the ground set $\mathcal{G}$ is a nonempty polytope contained in $[0,1]^n$. This…

Optimization and Control · Mathematics 2025-10-21 Santanu S. Dey , Burak Kocuk

This article proposes a new discrete framework for approximating solutions to shape optimization problems under convexity constraints. The numerical method, based on the support function or the gauge function, is guaranteed to generate…

Optimization and Control · Mathematics 2022-03-15 Beniamin Bogosel

We study the polyhedral structure of the static probabilistic lot-sizing problem and propose valid inequalities that integrate information from the chance constraint and the binary setup variables. We prove that the proposed inequalities…

Optimization and Control · Mathematics 2020-06-02 Xiao Liu , Simge Kucukyavuz