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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:3/0  |  提交时间:2024/02/05
Inhibition performance of 4-mercaptopyridine toward the corrosion of carbon steel in hydrochloric acid solution 期刊论文
JOURNAL OF ADHESION SCIENCE AND TECHNOLOGY, 2021, 页码: 15
作者:  Han, Peng;  Sun, Xin;  Zhang, Buyun;  Chang, Zhixuan;  Shen, Ji
收藏  |  浏览/下载:44/0  |  提交时间:2022/02/18
Molecular dynamics study on the stability of foot-and-mouth disease virus particle in salt solution 期刊论文
MOLECULAR SIMULATION, 2021, 页码: 8
作者:  Li, Chen;  Chen, Wei;  Lin, Xuan;  Zhang, Songping;  Wang, Yufei
收藏  |  浏览/下载:16/0  |  提交时间:2021/08/31
Effect of H2O Molecules on the CO2 Replacement in CH4 Hydrate Behavior by Molecular Simulation 期刊论文
ENERGY & FUELS, 2021, 卷号: 35, 期号: 9, 页码: 8126-8140
作者:  Yan, Ke-Feng;  Chen, Hao;  Chen, Zhao-Yang;  Li, Xiao-Sen;  Xu, Chun-Gang
收藏  |  浏览/下载:16/0  |  提交时间:2021/10/27
Thermal Transport in Graphene Nanomesh: Unraveling the Role of Brillouin Zone Folding, Phonon Localization and Phonon Confinement 期刊论文
INTERNATIONAL JOURNAL OF HEAT AND MASS TRANSFER, 2021, 卷号: 165, 页码: -
作者:  Cui, Liu;  Wei, Gaosheng;  Li, Zhao;  Du, Xiaoze
收藏  |  浏览/下载:3/0  |  提交时间:2021/03/12
Exploring binding mechanisms of VEGFR2 with three drugs lenvatinib, sorafenib, and sunitinib by molecular dynamics simulation and free energy calculation 期刊论文
CHEMICAL BIOLOGY & DRUG DESIGN, 2019, 卷号: 93, 期号: 5, 页码: 934-948
作者:  Wang, Yu;  Peng, Cheng;  Wang, Guimin;  Xu, Zhijian;  Luo, Yongfeng
收藏  |  浏览/下载:18/0  |  提交时间:2020/07/01
Inclusion of Machine Learning Kernel Ridge Regression Potential Energy Surfaces in On-the-Fly Nonadiabatic Molecular Dynamics Simulation 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2018, 卷号: 9, 期号: 11, 页码: 2725-2732
作者:  Hu, Deping;  Xie, Yu;  Li, Xusong;  Li, Lingyue;  Lan, Zhenggang
收藏  |  浏览/下载:37/0  |  提交时间:2018/12/21
The atomistic simulation study of Ag/MgO interface tension fracture 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2018, 卷号: 142, 页码: 277-284
作者:  You XM(尤雪梅);  Liang LH(梁立红);  Wei YG(魏悦广);  Liang, LH;  Wei, YG
收藏  |  浏览/下载:25/0  |  提交时间:2017/12/18
A new understanding on thermal efficiency of organic Rankine cycle: Cycle separation based on working fluids properties 期刊论文
ENERGY CONVERSION AND MANAGEMENT, 2018, 卷号: 157, 页码: 169-175
作者:  Wang, Yongzhen;  Zhao, Jun;  Chen, Guibing;  Deng, Shuai;  An, Qingsong
收藏  |  浏览/下载:22/0  |  提交时间:2020/10/29
Synthesis of STW zeolites using imidazolium-based dications of varying length 期刊论文
JOURNAL OF MATERIALS CHEMISTRY A, 2018, 卷号: 6, 期号: 4, 页码: 1485-1495
作者:  Lu, Peng;  Gomez-Hortiguela, Luis;  Xu, Lei;  Camblor, Miguel A.
收藏  |  浏览/下载:21/0  |  提交时间:2019/06/20


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