理论化学模拟实验室

作者 Haijuan Zhang · Yongxin Gao · Hengyue Xu · Daqin Guan · Zhiwei Hu · Chao Jing · Yuchen Sha · Yuxing Gu · Yu-Cheng Huang · Yu‐Chung Chang · Chi‐Wen Pao · Xiaomin Xu · Jyh‐Fu Lee · Yi‐Ying Chin · Hong‐Ji Lin · Chien‐Te Chen · Yuhui Chen · Youmin Guo · Meng Ni · Wei Zhou · Zongping Shao

Embedding Atomically Dispersed Iron Sites in Nitrogen‐Doped Carbon Frameworks‐Wrapped Silicon Suboxide for Superior Lithium Storage

2022

期刊 Advanced Science

作者 Xiaotian Guo · Hengyue Xu · Wenting Li · Yangyi Liu · Yuxin Shi · Qing Li · Huan Pang

Exceptional Anisotropic Noncovalent Interactions in Ultrathin Nanorods: The Terminal σ-Hole

2022

期刊 ACS Applied Materials & Interfaces

作者 Hengyue Xu · Daqin Guan

Tensile‐Strained RuO 2 Loaded on Antimony‐Tin Oxide by Fast Quenching for Proton‐Exchange Membrane Water Electrolyzer

2022

期刊 Advanced Science

作者 Bing Huang · Hengyue Xu · Nannan Jiang · Minghao Wang · Jianren Huang · Lunhui Guan

Structure, stability, electronic and magnetic properties of monometallic Pd, Pt, and bimetallic Pd-Pt core–shell nanoparticles

2020

期刊 Chemical Physics

作者 Hengyue Xu · Pengfei Liu · Wenjie Zhang · Qiang Wang · Yanhui Yang

The adaptability of H9N2 avian influenza A virus to humans: A comparative docking simulation study

2020

期刊 Biochemical and Biophysical Research Communications

作者 Hengyue Xu · Jiaqiang Qian · Yifan Song · Dengming Ming

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3D nanothorn cluster-like Zn-Bi2S3 sensitized WO3/ZnO multijunction with electron-storage characteristic and adjustable energy band for improving sustained photoinduced cathodic protection application

The bio-inspired heterogeneous single-cluster catalyst Ni100–Fe<sub>4</sub>S<sub>4</sub> for enhanced electrochemical CO<sub>2</sub> reduction to CH<sub>4</sub>

The Dual‐Site Adsorption and High Redox Activity Enabled by Hybrid Organic‐Inorganic Vanadyl Ethylene Glycolate for High‐Rate and Long‐Durability Lithium–Sulfur Batteries

A universal chemical-induced tensile strain tuning strategy to boost oxygen-evolving electrocatalysis on perovskite oxides

Combined Corner‐Sharing and Edge‐Sharing Networks in Hybrid Nanocomposite with Unusual Lattice‐Oxygen Activation for Efficient Water Oxidation

Embedding Atomically Dispersed Iron Sites in Nitrogen‐Doped Carbon Frameworks‐Wrapped Silicon Suboxide for Superior Lithium Storage

Exceptional Anisotropic Noncovalent Interactions in Ultrathin Nanorods: The Terminal σ-Hole

Tensile‐Strained RuO <sub>2</sub> Loaded on Antimony‐Tin Oxide by Fast Quenching for Proton‐Exchange Membrane Water Electrolyzer

Structure, stability, electronic and magnetic properties of monometallic Pd, Pt, and bimetallic Pd-Pt core–shell nanoparticles

The adaptability of H9N2 avian influenza A virus to humans: A comparative docking simulation study