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Computational Screening of Single Atoms Anchored on Defective Mo2CO2 MXene Nanosheet as Efficient Electrocatalysts for the Synthesis of Ammonia 期刊论文
ADVANCED ENGINEERING MATERIALS, 2021, 页码: 8
作者:  Wang, Shuo;  Li, Lei;  San Hui, Kwan;  Bin F(宾峰);  Zhou, Wei;  Fan, Xi;  Zalnezhad, E.;  Li, Jing;  Hui, Kwun Nam
Adobe PDF(1142Kb)  |  收藏  |  浏览/下载：313/74  |  提交时间：2021/08/16
density functional theory calculations  electrocatalysis  MXene  nitrogen reduction reaction  single-atom catalysts  
Reconstruction model for heat release rate based on artificial neural network 期刊论文
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2021, 卷号: 46, 期号: 37, 页码: 19599-19616
作者:  Li B(李波);  Yao W(姚卫);  Li YC(李亚超);  Fan XJ(范学军)
Adobe PDF(5169Kb)  |  收藏  |  浏览/下载：113/30  |  提交时间：2022/10/25
Heat release rate (HRR)  Artificial neural network (ANN)  Proper orthogonal -12omposition (POD)  Chemiluminescence  Supersonic hydrogen flame  
High-Throughput Screening of Nitrogen-Coordinated Bimetal Catalysts for Multielectron Reduction of CO2 to CH4 with High Selectivity and Low Limiting Potential 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY C, 2021, 卷号: 125, 期号: 13, 页码: 7155-7165
作者:  Wang Shuo;  Li Lei;  Li Jing;  Yuan Chengzong;  Kang Yao;  Hui Kwan San;  Zhang Jintao;  Bin F(宾峰);  Fan Xi;  Chen Fuming;  Hui Kwun Nam
Adobe PDF(6747Kb)  |  收藏  |  浏览/下载：429/127  |  提交时间：2021/05/17