"au:"Daye Zheng"" — arXiv2 Search

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/ Date/ Name

"au:"Daye Zheng"" — arXiv2 Search

Showing 1–8 of 8 results

/ Date/ Name

Jan 12, 2020Retention and Recycling of Deuterium in Liquid Lithium-Tin Slab Studied by First-Principles Molecular Dynamics Jan 24, 2025Integrating Deep-Learning-Based Magnetic Model and Non-Collinear Spin-Constrained Method: Methodology, Implementation and Application May 31, 2023Implementation of the SCAN Exchange-Correlation Functional with Numerical Atomic Orbitals May 31, 2021Calculation of Berry curvature using nonorthogonal atomic orbitals Jan 15, 2025ABACUS: An Electronic Structure Analysis Package for the AI Era Jan 14, 2017First-principles molecular dynamics study of deuterium diffusion in liquid tin Dec 4, 2025Accelerating discovery of infrared nonlinear optical materials with large shift current via high-throughput screening Jun 21, 2022DeePKS+ABACUS as a Bridge between Expensive Quantum Mechanical Models and Machine Learning Potentials