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Topological defect and sp3/sp2 carbon interface derived from ZIF-8 with linker vacancies for oxygen reduction reaction 期刊论文
CARBON, 2023, 卷号: 203, 页码: 76-87
作者:  Gao, Haixing;  Wang, Shuo;  Cheong, Weng-Chon (Max);  Wang, Kaixi;  Xu, Huifang;  Huang, Aijian;  Ma, Junguo;  Li, Jiazhan;  Ip, Weng-Fai (Andy);  San Hui, Kwan;  Dinh, Duc Anh;  Fan, Xi;  Bin F(宾峰);  Chen, Fuming;  Hui, Kwun Nam
Adobe PDF(2761Kb)  |  收藏  |  浏览/下载：86/1  |  提交时间：2023/01/12
Metal-free  Carbon-based materials  Metal-organic framework  Defect chemistry  Metal-air battery  
An improved stiff-ODE solving framework for reacting flow simulations with detailed chemistry in OpenFOAM 期刊论文
COMBUSTION THEORY AND MODELLING, 2023, 卷号: 27, 期号: 1, 页码: 57-82
作者:  Wu K(吴坤);  Jiang YT(蒋雨廷);  Huo ZJ(霍志杰);  Cheng D(程迪);  Fan XJ(范学军)
Adobe PDF(3242Kb)  |  收藏  |  浏览/下载：115/8  |  提交时间：2023/02/03
reacting flow simulation  detailed chemistry  stiff ODE  Jacobian  linear system solver  
Comprehensive Analyses on the Influential Factors in Supersonic Combustion Simulation Using Dynamic Adaptive Chemistry Method 期刊论文
COMBUSTION SCIENCE AND TECHNOLOGY, 2022, 页码: 29
作者:  Wu K(吴坤);  Contino, Francesco;  Fan XJ(范学军)
Adobe PDF(14452Kb)  |  收藏  |  浏览/下载：225/21  |  提交时间：2022/09/27
Dynamic adaptive chemistry  mechanism reduction method  error threshold  search initiating species  High-fidelity numerical simulation  
Defining kerogen maturity from orbital hybridization by machine learning 期刊论文
FUEL, 2022, 卷号: 310, 页码: 10
作者:  Ma J(马俊);  Kang DL(康东亮);  Wang XH(王晓荷);  Zhao YP(赵亚溥)
Adobe PDF(4071Kb)  |  收藏  |  浏览/下载：279/59  |  提交时间：2021/11/29
Kerogen maturity  Orbital hybridization  Machine learning  Quantum chemistry  
On jet-wake flame stabilization in scramjet: A LES/RANS study from chemical kinetic and fluid-dynamical perspectives 期刊论文
AEROSPACE SCIENCE AND TECHNOLOGY, 2022, 卷号: 120, 页码: 12
作者:  Wu K(吴坤);  Zhang, Peng;  Fan XJ(范学军)
Adobe PDF(3834Kb)  |  收藏  |  浏览/下载：303/44  |  提交时间：2022/01/24
Supersonic combustion  Jet-wake flame stabilization  Hybrid LES  RANS  Detailed hydrogen chemistry  Counter-rotating vortex pair  
SPONGE: A GPU-Accelerated Molecular Dynamics Package with Enhanced Sampling and AI-Driven Algorithms 期刊论文
CHINESE JOURNAL OF CHEMISTRY, 2022, 卷号: 40, 期号: 1, 页码: 160-168
作者:  Huang YP;  Xia YJ;  Yang LJ;  Wei JC(韦佳辰);  Yang YI;  Gao YQ
Adobe PDF(1978Kb)  |  收藏  |  浏览/下载：234/43  |  提交时间：2022/01/13
Molecular dynamics  Molecular modeling  Enhanced sampling  Machine learning  Computational chemistry  
Diffusion of Nanoparticles with Activated Hopping in Crowded Polymer Solutions 期刊论文
NANO LETTERS, 2020, 卷号: 20, 期号: 5, 页码: 3895-3904
作者:  Xue CD;  Shi XH;  Tian Y;  Zheng X(郑旭);  Hu GQ
Adobe PDF(1913Kb)  |  收藏  |  浏览/下载：237/147  |  提交时间：2020/12/28
hopping diffusion  DYNAMICS  non-Gaussianity  MOBILITY  activated energy barrier  ULTRASOUND  crowded polymer solutions  CHEMISTRY  VISCOSITY  ROTATION  NANORODS  
Application of dynamic zone flamelet model to a GH2/GO2 rocket combustor 会议论文
AIAA Propulsion and Energy Forum and Exposition, 2019, Indianapolis, IN, United states, August 19, 2019 - August 22, 2019
作者:  Yao W(姚卫);  Li B(李波)
Adobe PDF(1665Kb)  |  收藏  |  浏览/下载：140/43  |  提交时间：2020/11/20
Dynamic zone flamelet model  GH2/GO2  Large Eddy Simulation (LES)  Rocket combustor  Turbulence-chemistry interaction  
Modeling Analysis on Cavity-based Flame Stabilization in Scramjet Combustor 会议论文
12th Asia-Pacific Conference on Combustion, ASPACC 2019, Fukuoka, Japan, July 1, 2019 - July 5, 2019
作者:  Wu K(吴坤);  Zhang P(张鹏);  Fan XJ(范学军)
收藏  |  浏览/下载：130/0  |  提交时间：2019/11/20
Combustion chemistry  Combustion dynamics  Dual  mode scramjet  Flame stabilization  Improved delayed detached eddy simulations  Overall reactions  Scramjet combustors  Shock  wave structures  
On the application of tabulated dynamic adaptive chemistry in ethylene-fueled supersonic combustion 期刊论文
COMBUSTION AND FLAME, 2018, 卷号: 197, 页码: 265-275
作者:  Wu K(吴坤);  Contino F;  Yao W(姚卫);  Fan XJ(范学军)
浏览  |  Adobe PDF(4270Kb)  |  收藏  |  浏览/下载：509/177  |  提交时间：2018/12/12
Tabulated dynamic adaptive chemistry  Skeletal mechanism  Supersonic combustion  Ethylene  Large Eddy Simulation