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Creators/Authors contains: "Yu, Yue"

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  1. Realizing two-dimensional (2D) altermagnets is important for spintronics applications. Here we propose a microscopic template for stabilizing 2D altermagnetism through Van Hove singularities that are coincident in both energy and momentum. These coincident Van Hove singularities are a generic consequence of non-symmorphic symmetries in nine 2D space groups. Due to nontrivial symmetry properties of the Hamiltonian, these coincident Van Hove singularities allow new hopping interactions between the Van Hove singularities that do not appear in analogous Van Hove singularity based patch models for cuprates and graphene. We show these new interactions can give rise to various weak coupling, and BCS-based instabilities, including altermagnetism, nematicity, inter-band d-wave superconductivity, and orbital altermagnetic order. We apply our results to quasi-2D organic κ-Cl in which altermagnetism is known to appear 
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  2. Abstract In scientific machine learning (SciML), a key challenge is learning unknown, evolving physical processes and making predictions across spatio-temporal scales. For example, in real-world manufacturing problems like additive manufacturing, users adjust known machine settings while unknown environmental parameters simultaneously fluctuate. To make reliable predictions, it is desired for a model to not only capture long-range spatio-temporal interactions from data but also adapt to new and unknown environments; traditional machine learning models excel at the first task but often lack physical interpretability and struggle to generalize under varying environmental conditions. To tackle these challenges, we propose the attention-based spatio-temporal neural operator (ASNO), a novel architecture that combines separable attention mechanisms for spatial and temporal interactions and adapts to unseen physical parameters. Inspired by the backward differentiation formula, ASNO learns a transformer for temporal prediction and extrapolation and an attention-based neural operator for handling varying external loads, enhancing interpretability by isolating historical state contributions and external forces, enabling the discovery of underlying physical laws and generalizability to unseen physical environments. Empirical results on SciML benchmarks demonstrate that ASNO outperforms existing models, establishing its potential for engineering applications, physics discovery, and interpretable machine learning. 
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  3. Altermagnets break time-reversal symmetry, and their spin-orbit coupling (SOC) allows for an anomalous Hall effect (AHE) that depends on the direction of the N´eel ordering vector. The AHE and the ferromagnetic spin moment share the same symmetry and hence are usually proportional. However, density functional theory (DFT) calculations find that the AHE exists with negligible ferromagnetic spin moment for some compounds, whereas it reaches sizable values for other altermagnets. By examining realistic minimal models for altermagnetism in which the DFT phenomenology is captured, we uncover a general SOC-enabled quasisymmetry, the uniaxial spin space group, that provides a natural explanation for the amplitude of the ferromagnetic spin moment across the vast range of different altermagnetic materials. Additionally, we derive analytic expressions for the magnetic anisotropy energy, providing a simple means of identifying the preferred N´eel vector orientation for altermagnets. 
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  4. Abstract We introduce a new concept of the local flux conservation and investigate its role in the coupled flow and transports. We demonstrate how the proposed concept of the locally conservative flux can play a crucial role in obtaining the$$L^2$$ L 2 norm stability of the discontinuous Galerkin finite element scheme for the transport in the coupled system with flow. In particular, the lowest order discontinuous Galerkin finite element for the transport is shown to inherit the positivity and maximum principle when the locally conservative flux is used, which has been elusive for many years in literature. The theoretical results established in this paper are based on the equivalence between Lesaint-Raviart discontinuous Galerkin scheme and Brezzi-Marini-Süli discontinuous Galerkin scheme for the linear hyperbolic system as well as the relationship between the Lesaint-Raviart discontinuous Galerkin scheme and the characteristic method along the streamline. Sample numerical experiments have then been performed to justify our theoretical findings. 
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  5. Realizing odd-parity, time-reversal-preserving, nonrelativistic spin splitting is a central goal for spintronics applications. We propose a group-theory-based microscopic framework to induce odd-parity spin splitting from coplanar antiferromagnetic (AFM) states without spin-orbit coupling (SOC). We develop phenomenological models for 421 conventional period-doubling AFM systems in nonsymmorphic space groups and construct minimal microscopic models for 119 of these. We find that these AFM states can attain three possible competing ground states. These ground states all break symmetries in addition to those broken by the usual AFM order. Specifically, they give rise to either odd-parity spin-splitting, nematic order, or scalar odd-parity order related to multiferroicity. Our microscopic theories reveal that the oddparity spin-splitting energy scale is generically large and further reveal that the scalar odd-parity order gives a nonzero Berry curvature dipole without SOC. We identify 67 materials in the Magndata database for which our theory applies. We provide density-functional theory (DFT) calculations on Fe-based materials that reveal an h-wave spin splitting consistent with our symmetry arguments and apply our microscopic model to determine the nonrelativistic Edelstein response for CeNiAsO. 
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  6. Altermagnets constitute a class of collinear compensated Néel ordered magnets that break time-reversal symmetry and feature spin-split band structures. Based on versatile microscopic models able to capture the altermagnetic sublattice degrees of freedom, we study characteristic local signatures of altermagnetism near disorder sites. We give a complete list of two-dimensional models that exhibit altermagnetism classified by their corresponding layer groups. Specifically, we calculate the local density of states in the vicinity of pointlike nonmagnetic impurities and expose its spatial dependence for two minimal models showcasing d-wave and g-wave altermagnetism. The momentum structure of the nodes (d-wave, g-wave, etc.) is directly imprinted on the total local density of states, thus measurable by scanning tunneling conductance experiments. This signature is present both in the spin-resolved as well as the spin-summed local density of states. We find a weaker response in the nonmagnetic state from the anisotropic crystal environment and uncover the importance of the sublattice degree of freedom to model altermagnets. We also study coexistence phases of altermagnetism and superconductivity and provide predictions for the local impurity response of in-gap bound states. The response of impurity bound states strongly enhances the distinct altermagnetic signature 
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