Publications by authors named "Peize Lin"

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ABACUS: An electronic structure analysis package for the AI era.
Weiqing Zhou, Daye Zheng, Qianrui Liu, Denghui Lu, Yu Liu, Peize Lin, Menglin Sun, Linfeng Zhang

J Chem Phys· November 2025

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Applying Space-Group Symmetry to Speed Up Hybrid-Functional Calculations within the Framework of Numerical Atomic Orbitals.
Yu Cao, Min-Ye Zhang, Peize Lin, Mohan Chen, Xinguo Ren

J Chem Theory Comput· August 2025

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Efficient Hybrid-Functional-Based Force and Stress Calculations for Periodic Systems with Thousands of Atoms.
Peize Lin, Yuyang Ji, Lixin He, Xinguo Ren

J Chem Theory Comput· April 2025

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TROPOMI unravels transboundary transport pathways of atmospheric carbon monoxide in Tibetan Plateau.
Peize Lin, Yuan Tian, Tobias Borsdorff, Zhiwei Li, Jochen Landgraf

Sci Total Environ· November 2024

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A deep equivariant neural network approach for efficient hybrid density functional calculations.
Zechen Tang, He Li, Peize Lin, Xiaoxun Gong, Gan Jin

Nat Commun· October 2024

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Reproducibility of Hybrid Density Functional Calculations for Equation-of-State Properties and Band Gaps.
Yuyang Ji, Peize Lin, Xinguo Ren, Lixin He

J Phys Chem A· September 2022

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Efficient Hybrid Density Functional Calculations for Large Periodic Systems Using Numerical Atomic Orbitals.
Peize Lin, Xinguo Ren, Lixin He

J Chem Theory Comput· January 2021

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Accuracy of Localized Resolution of the Identity in Periodic Hybrid Functional Calculations with Numerical Atomic Orbitals.
Peize Lin, Xinguo Ren, Lixin He

J Phys Chem Lett· April 2020

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