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328 积分 2025-09-24 加入
ReaxFF Reactive Molecular Dynamics Study on Methanation Reaction from Syngas
15天前
已完结
Enhanced sampling in molecular dynamics simulations and their latest applications—A review
21天前
已完结
JAX-ReaxFF: A Gradient-Based Framework for Fast Optimization of Reactive Force Fields
2个月前
已完结
A site-sensitive quasi-in situ strategy to characterize Mo/HZSM-5 during activation
6个月前
已完结
Relation of Catalytic Performance to the Aluminum Siting of Acidic Zeolites in the Conversion of Methanol to Olefins, Viewed via a Comparison between ZSM-5 and ZSM-11
6个月前
已完结
Quantum mechanics based mechanisms for selective activation of hydrocarbons by mixed metal oxide heterogeneous catalysts – A tribute to Robert Grasselli
6个月前
已完结
Structures, Mechanisms, and Kinetics of Ammoxidation and Selective Oxidation of Propane Over the M2 Phase of MoVNbTeO Catalysts
6个月前
已完结
Quantitative 2D liquid‐state NMR
7个月前
已完结
How do the products in methane dehydroaromatization impact the distinct stages of the reaction?
7个月前
已完结
Non-oxidative dehydroaromatization of methane over Mo/H-ZSM-5 catalysts: A detailed analysis of the reaction-regeneration cycle
7个月前
已完结