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164 积分 2024-11-25 加入
First-principles study on the co-adsorption of water and oxygen molecules on chalcopyrite (112)-M surface
9天前
已完结
Promoting gas adsorption and charge transfer by activating iron incorporation sites for high performance trimethylbenzene sensing
9天前
已完结
Tritium adsorption and desorption on/from nuclear graphite edge by a first-principles study
9天前
已完结
Adsorption behavior and surface modification of metal atoms on AlGaN surfaces with multiple configurations: First principle calculation assisted by machine learning
9天前
已完结
Surface modification of tungsten oxide by oxygen vacancies for hydrogen adsorption
9天前
已完结
Effects of O2, SO2, H2O and CO2 on As2O3 adsorption by γ-Al2O3 based on DFT analysis
9天前
已完结
Performance modulation of ZnO/WSSe heterojunction photodetectors via longitudinal stress bending
13天前
已完结
The selective adsorption mechanism of CO2 from biomass pyrolysis gas on N-doped carbon materials with an electric field: A first-principles study
13天前
已完结
Atomic-Scale Insights into CO2 and H2O Co-Adsorption on Sr2Fe1.5Mo0.5O6 Surfaces: Role of Electronic Structure and Dual-Site Interactions
13天前
已完结
The impact of nitrogen doping on Pt cluster-decorated carbon nanocones for CO2 hydrogenation to formic acid: A DFT study
13天前
已完结