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Ali Rayat

Publications and source records attributed to Ali Rayat.

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Graph Neural Network Force Fields for Spin Dynamics in Metallic Magnets

Metallic magnets exhibit complex spin dynamics governed by electronically generated interactions. Predictive simulations of such dynamics typically require repeated solutions of an underlying electronic problem throughout the time evolution, creating a major computational bottleneck. Here we introduce a graph neural network (GNN) magnetic force-field framework that learns the effective magnetic energy functional governing itinerant spin dynamics directly from electronic calculations. Conceptually analogous to machine-learned interatomic potentials, the proposed framework enables efficient evaluation of spin torques while capturing the nonlinear and spatially extended interactions generated by itinerant electrons. We benchmark the method on representative metallic magnetic systems exhibiting collinear, noncollinear, and noncoplanar magnetic order. The learned force fields accurately reproduce electronically generated spin torques and yield nonequilibrium spin dynamics in excellent agreement with direct electronic simulations. Our results establish graph neural networks as a powerful framework for machine-learned magnetic force fields, providing a pathway toward predictive large-scale simulations of nonequilibrium magnetism across multiple length and time scales.

cond-mat.str-el

Graph Neural Networks in the Wilson Loop Representation of Abelian Lattice Gauge Theories

Local gauge structures play a central role in a wide range of condensed matter systems and synthetic quantum platforms, where they emerge as effective descriptions of strongly correlated phases and engineered dynamics. We introduce a gauge-invariant graph neural network (GNN) architecture for Abelian lattice gauge models, in which symmetry is enforced explicitly through local gauge-invariant inputs, such as Wilson loops, and preserved throughout message passing, eliminating redundant gauge degrees of freedom while retaining expressive power. We benchmark the approach on both $\mathbb{Z}_2$ and $\mathrm{U}(1)$ lattice gauge models, achieving accurate predictions of global observables and spatially resolved quantities despite the nonlocal correlations induced by gauge-matter coupling. We further demonstrate that the learned model serves as an efficient surrogate for semiclassical dynamics in $\mathrm{U}(1)$ quantum link models, enabling stable and scalable time evolution without repeated fermionic diagonalization, while faithfully reproducing both local dynamics and statistical correlations. These results establish gauge-invariant message passing as a compact and physically grounded framework for learning and simulating Abelian lattice gauge systems.

cond-mat.str-el

Gauge-Equivariant Graph Neural Networks for Lattice Gauge Theories

Local gauge symmetry underlies fundamental interactions and strongly correlated quantum matter, yet existing machine-learning approaches lack a general, principled framework for learning under site-dependent symmetries, particularly for intrinsically nonlocal observables. Here we introduce a gauge-equivariant graph neural network that embeds non-Abelian symmetry directly into message passing via matrix-valued, gauge-covariant features and symmetry-compatible updates, extending equivariant learning from global to fully local symmetries. In this formulation, message passing implements gauge-covariant transport across the lattice, allowing nonlocal correlations and loop-like structures to emerge naturally from local operations. We validate the approach across pure gauge, gauge-matter, and dynamical regimes, establishing gauge-equivariant message passing as a general paradigm for learning in systems governed by local symmetry.

cond-mat.str-el