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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./通讯作者：Gao, Yi Qin
Authors:  Huang YP;  Xia YJ;  Yang LJ;  Wei JC(韦佳辰);  Yang YI;  Gao YQ
Adobe PDF(1978Kb)  |  Favorite  |  View/Download：362/109  |  Submit date：2022/01/13
Molecular dynamics  Molecular modeling  Enhanced sampling  Machine learning  Computational chemistry  
A comparative study of elliptical and round scramjet combustors by Improved Delayed Detached Eddy Simulation 会议论文
21st AIAA International Space Planes and Hypersonics Technologies Conference, Xiamen, China, 6-9 March 2017
Authors:  Yao W(姚卫);  Yuan YM(袁越明);  Li XP(李晓鹏);  Wang J(王晶);  Fan XJ(范学军);  Fan, Xuejun([email protected])
View  |  Adobe PDF(1173Kb)  |  Favorite  |  View/Download：583/286  |  Submit date：2018/01/16
Adiabatic Flame Temperature  Aerodynamics  Boundary Layer Flow  Boundary Layers  Chemical Analysis  Combustion  Computational Chemistry  Directed Graphs  Flow Separation  Mach Number  Principal Component Analysis  Regression Analysis  Sensitivity Analysis  Spacecraft  Supersonic Aerodynamics  Supersonic Aircraft  Transients  
Detailed modeling of the effects of K/Na additives on the thermal DeNO(x) process 期刊论文
ENERGY & FUELS, 2013, 卷号: 27, 期号: 1, 页码: 421-429
Authors:  Guo XF(郭啸峰);  Wei XL(魏小林);  Li S(李森);  Wei, XL (reprint author), Chinese Acad Sci, Inst Mech, State Key Lab High Temp Gas Dynam, Beijing 100190, Peoples R China.
Adobe PDF(628Kb)  |  Favorite  |  View/Download：1408/416  |  Submit date：2013/05/21
Computational Fluid Dynamics  Experiments  Oxygen  Potassium  Selective Catalytic Reduction  Sodium  Chemistry Mechanism  Detailed Chemical Kinetic  Detailed Modeling  Entrained Flow Reactor  Metal Additives  Na Concentration  No Reduction  Normalized Stoichiometric Ratio  Oxygen Concentrations  Promoting Effect  Radical Production  Reduced Mechanisms  Selective Non-catalytic Reduction  Sodium Additive  Temperature Range  Temperature Window  Thermal Deno