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Neural network force fields have significantly advanced ab initio atomistic simulations across diverse fields. However, their application in the realm of magnetic materials is still in its early stage due to challenges posed by the subtle…

Materials Science · Physics 2024-02-08 Zilong Yuan , Zhiming Xu , He Li , Xinle Cheng , Honggeng Tao , Zechen Tang , Zhiyuan Zhou , Wenhui Duan , Yong Xu

In recent years, the use of machine learning has become increasingly popular in the context of lattice field theories. An essential element of such theories is represented by symmetries, whose inclusion in the neural network properties can…

High Energy Physics - Lattice · Physics 2021-12-24 Srinath Bulusu , Matteo Favoni , Andreas Ipp , David I. Müller , Daniel Schuh

Physical theories grounded in mathematical symmetries are an essential component of our understanding of a wide range of properties of the universe. Similarly, in the domain of machine learning, an awareness of symmetries such as rotation…

Tensors are a fundamental data structure for many scientific contexts, such as time series analysis, materials science, and physics, among many others. Improving our ability to produce and handle tensors is essential to efficiently address…

Machine Learning · Statistics 2026-02-12 Wilson G. Gregory , Josué Tonelli-Cueto , Nicholas F. Marshall , Andrew S. Lee , Soledad Villar

We introduce the usage of equivariant neural networks in the search for violations of the charge-parity ($\textit{CP}$) symmetry in particle interactions at the CERN Large Hadron Collider. We design neural networks that take as inputs…

High Energy Physics - Phenomenology · Physics 2024-11-27 Sergio Sánchez Cruz , Marina Kolosova , Clara Ramón Álvarez , Giovanni Petrucciani , Pietro Vischia

We introduce Clifford Group Equivariant Neural Networks: a novel approach for constructing $\mathrm{O}(n)$- and $\mathrm{E}(n)$-equivariant models. We identify and study the $\textit{Clifford group}$, a subgroup inside the Clifford algebra…

Machine Learning · Computer Science 2023-10-24 David Ruhe , Johannes Brandstetter , Patrick Forré

Many scientific and geometric problems exhibit general linear symmetries, yet most equivariant neural networks are built for compact groups or simple vector features, limiting their reuse on matrix-valued data such as covariances, inertias,…

Machine Learning · Computer Science 2026-02-02 Chankyo Kim , Sicheng Zhao , Minghan Zhu , Tzu-Yuan Lin , Maani Ghaffari

We present a general framework for symmetrizing an arbitrary neural-network architecture and making it equivariant with respect to a given group. We build upon the proposals of Kim et al. (2023); Kaba et al. (2023) for symmetrization, and…

Machine Learning · Computer Science 2023-11-14 Tien Dat Nguyen , Jinwoo Kim , Hongseok Yang , Seunghoon Hong

We present the group equivariant conditional neural process (EquivCNP), a meta-learning method with permutation invariance in a data set as in conventional conditional neural processes (CNPs), and it also has transformation equivariance in…

Machine Learning · Computer Science 2021-02-18 Makoto Kawano , Wataru Kumagai , Akiyoshi Sannai , Yusuke Iwasawa , Yutaka Matsuo

We present a neural network architecture, Bispectral Neural Networks (BNNs) for learning representations that are invariant to the actions of compact commutative groups on the space over which a signal is defined. The model incorporates the…

Machine Learning · Computer Science 2023-05-23 Sophia Sanborn , Christian Shewmake , Bruno Olshausen , Christopher Hillar

We investigate the relation between end-to-end equivariance and layerwise equivariance in deep neural networks. We prove the following: For a network whose end-to-end function is equivariant with respect to group actions on the input and…

Machine Learning · Computer Science 2026-01-30 Vahid Shahverdi , Giovanni Luca Marchetti , Georg Bökman , Kathlén Kohn

We present a new class of equivariant neural networks, hereby dubbed Lattice-Equivariant Neural Networks (LENNs), designed to satisfy local symmetries of a lattice structure. Our approach develops within a recently introduced framework…

Computational Physics · Physics 2025-04-30 Giulio Ortali , Alessandro Gabbana , Imre Atmodimedjo , Alessandro Corbetta

We propose, implement, and compare with competitors a new architecture of equivariant neural networks based on geometric (Clifford) algebras: Generalized Lipschitz Group Equivariant Neural Networks (GLGENN). These networks are equivariant…

Machine Learning · Computer Science 2025-12-04 Ekaterina Filimoshina , Dmitry Shirokov

Incorporating permutation equivariance into neural networks has proven to be useful in ensuring that models respect symmetries that exist in data. Symmetric tensors, which naturally appear in statistics, machine learning, and graph theory,…

Machine Learning · Computer Science 2025-05-26 Edward Pearce-Crump

Gauge symmetries play a key role in physics appearing in areas such as quantum field theories of the fundamental particles and emergent degrees of freedom in quantum materials. Motivated by the desire to efficiently simulate many-body…

Strongly Correlated Electrons · Physics 2022-05-13 Di Luo , Giuseppe Carleo , Bryan K. Clark , James Stokes

We review a novel neural network architecture called lattice gauge equivariant convolutional neural networks (L-CNNs), which can be applied to generic machine learning problems in lattice gauge theory while exactly preserving gauge…

High Energy Physics - Lattice · Physics 2021-11-09 Matteo Favoni , Andreas Ipp , David I. Müller , Daniel Schuh

Lorentz Local Canonicalization (LLoCa) ensures exact Lorentz-equivariance for arbitrary neural networks with minimal computational overhead. For the LHC, it equivariantly predicts local reference frames for each particle and propagates…

High Energy Physics - Phenomenology · Physics 2025-11-11 Luigi Favaro , Gerrit Gerhartz , Fred A. Hamprecht , Peter Lippmann , Sebastian Pitz , Tilman Plehn , Huilin Qu , Jonas Spinner

Equivariant neural networks incorporate symmetries through group actions, embedding them as an inductive bias to improve performance. Existing methods learn an equivariant action on the latent space, or design architectures that are…

Machine Learning · Computer Science 2026-05-19 Riccardo Ali , Pietro Liò , Jamie Vicary

We show that the Lorentz-Equivariant Geometric Algebra Transformer (L-GATr) yields state-of-the-art performance for a wide range of machine learning tasks at the Large Hadron Collider. L-GATr represents data in a geometric algebra over…

High Energy Physics - Phenomenology · Physics 2025-10-29 Johann Brehmer , Víctor Bresó , Pim de Haan , Tilman Plehn , Huilin Qu , Jonas Spinner , Jesse Thaler

Symmetry learning has proven to be an effective approach for extracting the hidden structure of data, with the concept of equivariance relation playing the central role. However, most of the current studies are built on architectural theory…

Machine Learning · Statistics 2024-02-15 Masanori Koyama , Kenji Fukumizu , Kohei Hayashi , Takeru Miyato