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Chemistry (Weinheim an Der Bergstrasse, Germany)
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January 9, 2016
Water Adsorption and Dissociation on Ceria-Supported Single-Atom Catalysts: A First-Principles DFT+U Investigation
Zhong-Kang Han, Yi Gao
Journal of the American Chemical Society
|
June 30, 2026
Electron-Counting Controls Bifunctional Activity in Single-Atom Catalysts through a Three-Regime Adsorption Mechanism
Jiaqian Wang, Zhong-Kang Han
Nanoscale
|
November 20, 2014
A 2D-3D structure transition of gold clusters on CeO2-X(111) surfaces and its influence on CO and O2 adsorption: a comprehensive DFT + U investigation
Zhong-Kang Han, Yi Gao
JACS Au
|
May 2, 2025
Advancing the Understanding of Oxygen Vacancies in Ceria: Insights into Their Formation, Behavior, and Catalytic Roles
Zhong-Kang Han, Wen Liu, Yi Gao
Chemical Communications (Cambridge, England)
|
August 1, 2017
Catalytic role of vacancy diffusion in ceria supported atomic gold catalyst
Zhong-Kang Han, Yang-Gang Wang, Yi Gao
Journal of Chemical Theory and Computation
|
July 14, 2022
Improving Symbolic Regression for Predicting Materials Properties with Iterative Variable Selection
Zhen Guo, Shunbo Hu, Zhong-Kang Han, et al.
Journal of Chemical Theory and Computation
|
August 1, 2024
Global Optimization of Cation Ordering in Perovskites by Recommendation-Based Basin-Hopping
Yuxuan Zhang, Zhenjie Li, Zhong-Kang Han, et al.
The Journal of Physical Chemistry Letters
|
July 28, 2025
Accurate Performance Assessment of Lithium-Oxygen Batteries by Obtaining the Globally Stable Structures of Reaction Intermediates
Yan Wang, Xiaojuan Hu, Zhiyu Wang, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
July 13, 2021
The dynamic interplay between water and oxygen vacancy at the near-surface of ceria
Zhong-Kang Han, Xinyi Duan, Xiaoyan Li, et al.
Frontiers in Chemistry
|
July 6, 2019
The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO<sub>2</sub> (111) Under Strain
Zhong-Kang Han, Lei Zhang, Meilin Liu, et al.
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of 5
Search research articles
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Showing results (1-10 of 45) with videos related to
Sort By:
Page
of 5
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
January 9, 2016
Water Adsorption and Dissociation on Ceria-Supported Single-Atom Catalysts: A First-Principles DFT+U Investigation
Zhong-Kang Han, Yi Gao
Journal of the American Chemical Society
|
June 30, 2026
Electron-Counting Controls Bifunctional Activity in Single-Atom Catalysts through a Three-Regime Adsorption Mechanism
Jiaqian Wang, Zhong-Kang Han
Nanoscale
|
November 20, 2014
A 2D-3D structure transition of gold clusters on CeO2-X(111) surfaces and its influence on CO and O2 adsorption: a comprehensive DFT + U investigation
Zhong-Kang Han, Yi Gao
JACS Au
|
May 2, 2025
Advancing the Understanding of Oxygen Vacancies in Ceria: Insights into Their Formation, Behavior, and Catalytic Roles
Zhong-Kang Han, Wen Liu, Yi Gao
Chemical Communications (Cambridge, England)
|
August 1, 2017
Catalytic role of vacancy diffusion in ceria supported atomic gold catalyst
Zhong-Kang Han, Yang-Gang Wang, Yi Gao
Journal of Chemical Theory and Computation
|
July 14, 2022
Improving Symbolic Regression for Predicting Materials Properties with Iterative Variable Selection
Zhen Guo, Shunbo Hu, Zhong-Kang Han, et al.
Journal of Chemical Theory and Computation
|
August 1, 2024
Global Optimization of Cation Ordering in Perovskites by Recommendation-Based Basin-Hopping
Yuxuan Zhang, Zhenjie Li, Zhong-Kang Han, et al.
The Journal of Physical Chemistry Letters
|
July 28, 2025
Accurate Performance Assessment of Lithium-Oxygen Batteries by Obtaining the Globally Stable Structures of Reaction Intermediates
Yan Wang, Xiaojuan Hu, Zhiyu Wang, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
July 13, 2021
The dynamic interplay between water and oxygen vacancy at the near-surface of ceria
Zhong-Kang Han, Xinyi Duan, Xiaoyan Li, et al.
Frontiers in Chemistry
|
July 6, 2019
The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO<sub>2</sub> (111) Under Strain
Zhong-Kang Han, Lei Zhang, Meilin Liu, et al.
Page
of 5