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In crystallography, a structure is typically represented by the arrangement of atoms in the direct space. Furthermore, space group symmetry and Wyckoff site notations are applied to characterize crystal structures with only a few variables.…

Materials Science · Physics 2026-02-12 Osman Goni Ridwan , Hongfei Xue , Youxing Chen , Harish Cherukuri , Qiang Zhu

Symmetry groups are projectively represented in quantum mechanics, and crystalline symmetries are fundamental in condensed matter physics. Here, we systematically present a unified theory of quantum mechanical space groups from two…

Mathematical Physics · Physics 2020-09-17 Y. X. Zhao , L. B. Shao

In this thesis we consider crystal groups in dimension $n$ and their natural unitary representation on $L^2(\mathbb{R}^n)$. We show that this representation is unitarily equivalent to a direct integral of factor representations, and use…

Functional Analysis · Mathematics 2026-01-21 Tom Potter

We reformulate Fourier-space crystallography in the language of cohomology of groups. Once the problem is understood as a classification of linear functions on the lattice, restricted by a particular group relation, and identified by gauge…

Condensed Matter · Physics 2009-11-07 David A. Rabson , Benji Fisher

Incorporating known symmetries in data into machine learning models has consistently improved predictive accuracy, robustness, and generalization. However, achieving exact invariance to specific symmetries typically requires designing…

Machine Learning · Computer Science 2026-03-03 Cindy Y. Zhang , Elif Ertekin , Peter Orbanz , Ryan P. Adams

In this study, we introduce a method for learning group (known or unknown) equivariant functions by learning the associated quadratic form $x^T A x$ corresponding to the group from the data. Certain groups, known as orthogonal groups,…

Machine Learning · Computer Science 2025-10-16 Pavan Karjol , Vivek V Kashyap , Rohan Kashyap , Prathosh A P

We investigate the representations of the symmetry groups of infinite crystals. Crystal symmetries are usually described as the finite symmetry group of a finite crystal with periodic boundary conditions, for which the Brillouin zone is a…

Materials Science · Physics 2025-12-30 Bachir Bekka , Christian Brouder

Functions which are equivariant or invariant under the transformations of a compact linear group $G$ acting in an euclidean space $\real^n$, can profitably be studied as functions defined in the orbit space of the group. The orbit space is…

Mathematical Physics · Physics 2009-11-10 G. Sartori , G. Valente

We construct the meromorphic functions invariant under the action of the sense-preserving wallpaper groups on the complex plane. We discuss possible generalisa-tions of this to the general wallpaper groups. This provides the answer to a…

Classical Analysis and ODEs · Mathematics 2016-08-22 Richard Chapling

Euclidean deep learning is often inadequate for addressing real-world signals where the representation space is irregular and curved with complex topologies. Interpreting the geometric properties of such feature spaces has become paramount…

Computer Vision and Pattern Recognition · Computer Science 2024-09-12 Ramzan Basheer , Deepak Mishra

Functions which are covariant or invariant under the transformations of a compact linear group $G$ acting in a euclidean space $\real^n$, can be profitably studied as functions defined in the orbit space of the group. The orbit space is the…

Mathematical Physics · Physics 2007-05-23 G. Sartori , G. Valente

Transformation groups, such as translations or rotations, effectively express part of the variability observed in many recognition problems. The group structure enables the construction of invariant signal representations with appealing…

Artificial Intelligence · Computer Science 2013-01-17 Joan Bruna , Arthur Szlam , Yann LeCun

In this work, we formally prove that, under certain conditions, if a neural network is invariant to a finite group then its weights recover the Fourier transform on that group. This provides a mathematical explanation for the emergence of…

Machine Learning · Computer Science 2024-06-17 Giovanni Luca Marchetti , Christopher Hillar , Danica Kragic , Sophia Sanborn

Crystal structure modeling with graph neural networks is essential for various applications in materials informatics, and capturing SE(3)-invariant geometric features is a fundamental requirement for these networks. A straightforward…

Machine Learning · Computer Science 2025-03-05 Yusei Ito , Tatsunori Taniai , Ryo Igarashi , Yoshitaka Ushiku , Kanta Ono

In this article we study the structure of $\Gamma$-invariant spaces of $L^2(\bf R)$. Here $\bf R$ is a second countable LCA group. The invariance is with respect to the action of $\Gamma$, a non commutative group in the form of a semidirect…

Functional Analysis · Mathematics 2020-06-15 Davide Barbieri , Carlos Cabrelli , Eugenio Hernández , Ursula Molter

We define basic notions in the category of conic representations of a topological group and prove elementary facts about them. We show that a conic representation determines an ordinary dynamical system of the group together with a…

Dynamical Systems · Mathematics 2019-03-25 Matan Tal

In 1962, Bienenstock and Ewald described the classification of crystalline space groups algebraically in the dual, or Fourier, space. Recently, the method has been applied to quasicrystals and modulated crystals. This paper phrases…

Mathematical Physics · Physics 2007-05-23 Benji N. Fisher , David A. Rabson

A peculiar feature of quantum states is that they may embody so-called projective representations of symmetries rather than ordinary representations. Projective representations of space groups-the defining symmetry of crystals-remain…

Mesoscale and Nanoscale Physics · Physics 2023-02-14 Z. Y. Chen , Zheng Zhang , Shengyuan A. Yang , Y. X. Zhao

Crystallographic tilings of the Euclidean space $\mathbb{E}^n$ are defined as simple tilings whose group of isometric automorphisms is crystallographic. To classify crystallographic tilings by their automorphism groups it is necessary to…

Dynamical Systems · Mathematics 2017-08-30 Hawazin Alzahrani , Thomas Eckl

This paper is devoted to the problem of choosing the most suitable model of a geometrical system for describing the real crystallographic space. It has been shown that all 230 crystallographic groups used to describe the crystalline…

Materials Science · Physics 2017-04-13 A. P. Klishin , S. V. Rudnev
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