Author

Bo-Yang Deng

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Preprint Sep 2026

Unbiased first-principles construction of complete tensorial spin Hamiltonians

Magnetic ground states are commonly predicted using spin Hamiltonians whose interaction terms are selected a priori, potentially overlooking the microscopic interactions that govern complex magnetic order. Here, we introduce a general framework for the unbiased first-principles construction of symmetry-complete tensori...

Haichang Lu, Bo-Yang Deng, H. Katsumoto et al. · 0 citations