Lv4
510 积分 2025-06-17 加入
Interpretable machine learning‐assisted high‐throughput screening of highly active nitrogen fixation dual‐atom catalysts
11天前
已完结
Improved Pearson Correlation Coefficient-Based Graph Neural Network for Dynamic Soft Sensor of Polypropylene Industries
11天前
已完结
Molecular Model Construction of Low-Quality Coal and Molecular Simulation of Chemical Bond Energy Combined with Materials Studio
11天前
已完结
The Calculation of Both Electrostatic and Van der Waals Effects to Probe the Efficiency of Solvent Extraction of Heterocyclic Aromatics from Heavy Oil
11天前
已完结
The non-isothermal and isothermal pyrolysis mechanism of Longmaxi type II oil shale kerogen: A ReaxFF molecular dynamics study
11天前
已完结
Atomistic Scale Modeling of Anode/Electrolyte Interfaces in Li-Ion Batteries
11天前
已完结
Molecular dynamics study on structural characteristics of amorphous C‐S‐H with different Ca/Si ratios
11天前
已完结
Ab Initio Valence Bond Molecular Dynamics: A Study of SN2 Reaction Mechanisms
11天前
已关闭
Fundamental understanding of carbon evolution in polycarbosilane derived SiC ceramics: a ReaxFF molecular dynamics study
12天前
已完结
ReaxFF-Based Molecular Dynamics Study of the Mechanism of the Reaction of N2O4 with H2O
13天前
已完结
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