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Stable and 7.7 wt% hydrogen storage capacity of Ti decorated Irida-Graphene from first-principles calculations 期刊论文
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2024, 卷号: 50, 页码: 738-748
作者:  Tan, Yongkang;  Tao, Xiaoma;  Ouyang, Yifang;  Peng Q(彭庆)
收藏  |  浏览/下载:38/0  |  提交时间:2024/02/05
Irida-graphene  Hydrogen storage  Titanium decoration  First-principles calculation  
Superior hydrogen permeation resistance via Ni-graphene nanocomposites: Insights from atomistic simulations 期刊论文
JOURNAL OF MATERIALS RESEARCH AND TECHNOLOGY-JMR&T, 2024, 卷号: 28, 页码: 2086-2097
作者:  Huang, Hai;  Peng Q(彭庆);  Tang, Xiaobin
收藏  |  浏览/下载:33/0  |  提交时间:2024/02/19
Hydrogen embrittlement  Ni/graphene interface  Diffusion  Trapping  Permeation resistance  Atomistic simulations  
Enhancing the Mechanical Stability of 2D Fullerene with a Graphene Substrate and Encapsulation 期刊论文
NANOMATERIALS, 2023, 卷号: 13, 期号: 13, 页码: 1936
作者:  Yu, Taotao;  Li, Jianyu;  Han, Mingjun;  Zhang, Yinghe;  Li, Haipeng;  Peng Q(彭庆);  Tang, HoKin
Adobe PDF(9854Kb)  |  收藏  |  浏览/下载:18/0  |  提交时间:2023/09/05
monolayer fullerene  fracture behavior  molecular dynamics simulation  tensile property  pre-crack system  graphene substrate  
Effects of Crack Formation on the Mechanical Properties of Bilayer Graphene: A Comparative Analysis 期刊论文
CRYSTALS, 2023, 卷号: 13, 期号: 4, 页码: 584
作者:  Yu, Taotao;  Li, Jianyu;  Yang, Ziqiang;  Li, Haipeng;  Peng Q(彭庆);  Tang, HoKin
Adobe PDF(4081Kb)  |  收藏  |  浏览/下载:28/0  |  提交时间:2023/06/15
bilayer graphene  molecular dynamics simulation  mechanical properties  Young's modulus  precrack system  
A Review of the Mechanical Properties of Graphene Aerogel Materials: Experimental Measurements and Computer Simulations 期刊论文
MATERIALS, 2023, 卷号: 16, 期号: 5, 页码: 1800
作者:  Qi, Penghao;  Zhu, Hanxing;  Borodich, Feodor;  Peng Q(彭庆)
Adobe PDF(14377Kb)  |  收藏  |  浏览/下载:32/0  |  提交时间:2023/04/20
aerogel  graphene  mechanical properties  computational simulation  experiment measurements  
Defective Graphene Effects on Primary Displacement Damage and He Diffusion at a Ni Graphene Interface: Molecular Dynamics Simulations 期刊论文
CRYSTALS, 2023, 卷号: 13, 期号: 2, 页码: 198
作者:  Huang, Hai;  Yuan, Xiaoting;  Ge, Xiaoxin;  Peng Q(彭庆)
Adobe PDF(15865Kb)  |  收藏  |  浏览/下载:23/0  |  提交时间:2023/04/20
Ni graphene interface  defective graphene  displacement damage  He diffusion  molecular dynamics  
Interfacial Characteristics of Graphene-Reinforced Iron Composites: A Molecular Dynamics Study 期刊论文
CRYSTALS, 2023, 卷号: 13, 期号: 1, 页码: 12
作者:  Song, Miaomiao;  Jin, Jianfeng;  Wang, Lu;  Li, Shaojie;  Wang, Huiming;  Tang, Shuai;  Peng Q(彭庆)
Adobe PDF(3881Kb)  |  收藏  |  浏览/下载:99/5  |  提交时间:2023/02/27
graphene-reinforced iron matrix composite  interfacial characteristic  molecular dynamics simulation  moire pattern  crystallographic orientation