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The Journal of Physical Chemistry. A|February 23, 2024
Deep Potential Molecular Dynamics Study of Propane Oxidative DehydrogenationZiyi Liu, An-Hui Lu, Dongqi Wang
The Journal of Physical Chemistry Letters|December 13, 2022
In Situ Generated Boron Peroxo as Mild Oxidant in Propane Oxidative Dehydrogenation Revealed by Density Functional Theory StudyYuchen Liu, Ziyi Liu, Wen-Duo Lu, et al.
The Journal of Physical Chemistry Letters|September 7, 2021
Understanding the Unique Antioxidation Property of Boron-Based Catalysts during Oxidative Dehydrogenation of AlkanesZiyi Liu, Deting Xu, Miaoren Xia, et al.
Physical Chemistry Chemical Physics : PCCP|July 9, 2024
A thermodynamic model of the surface hydroxylation of γ-Al2O3Ying Ma, Fan Tang, Ziyi Liu, et al.
Physical Chemistry Chemical Physics : PCCP|July 16, 2019
The folding equilibria of enterobactin enantiomers and their interaction with actinidesZiyi Liu, Zhifang Chai, Dongqi Wang
The Journal of Physical Chemistry Letters|July 25, 2024
A Connected Convolutional Neutral Network Protocol for Design of Two-Dimensional Materials Based on Modified GraphdiyneJunqing Li, Ziyi Liu, Zhehuan Zhao, et al.
Inorganic Chemistry|April 22, 2024
Computational Comparative Study of the Binding of Americium with N-Donor LigandsXin Yan, Hui Jiang, Ziyi Liu, et al.
The Journal of Physical Chemistry. A|May 8, 2025
Prediction of Actinide-Ligand Complex Stability Constants by Machine LearningJunhong Li, Junqing Li, Ziyi Liu, et al.
Physical Chemistry Chemical Physics : PCCP|January 22, 2025
Knowledge-driven design of boron-based catalysts for oxidative dehydrogenation of propaneWeixi Chen, Ziyi Liu, Lihan Zhu, et al.
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