Author

Cheng-Ye Lu

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Preprint Sep 2026

Gauge-including neural-network quantum Monte Carlo for molecules in magnetic fields

External magnetic fields, through their coupling to orbital and spin motion, complicate the correlated electronic states and impose coordinate-dependent phases on the wavefunction, thereby making accurate electronic structure calculations substantially more demanding. Recently, neural network-based quantum Monte Carlo...

Cheng-Ye Lu, Wei-Zhong Fu, Xin-Gao Gong et al. · 0 citations

Preprint Sep 2026

First-Principles Electronic Structure Calculation of Crystals in Laboratory Magnetic Fields

External magnetic fields can qualitatively reshape the electronic structure of crystals, underpinning quantum Hall physics, Landau-level spectra and field-induced topological phases. Their first-principles treatment at laboratory-scale fields is, however, hindered by magnetic-flux quantization, which requires magnetic...

Si-Chao Wang, Cheng-Ye Lu, Xin-Gao Gong et al. · 0 citations