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182 积分 2025-03-05 加入
Electronic and optical properties of a hexagonal boron nitride monolayer in its pristine form and with point defects from first principles
1天前
待确认
Adsorption of NO2, SO2, H2S, and NH3 on Os-Doped WSe2 Monolayers: A First-Principles Study
1天前
已完结
A DFT study on defects and N doping to enhance hydrogen storage in Mg-decorated graphene
1天前
已完结
First principles study of NH3, H2S, Cl2, and C2H2 gases adsorption on defective GaSe monolayer
6天前
已完结
Two-dimensional carbon nitride (C3N) nanosheets as promising materials for H2S and NH3 elimination: A computational approach
7天前
已完结
Adsorption of NO gas molecule on the vacancy defected and transition metal doped antimonene: A first-principles study
8天前
已完结
Vacancy defects and Mo doping synergy in MgH2: A DFT study on hydrogen desorption and electronic enhancement
8天前
已完结
Tunable electronic and magnetic properties of MoSi2N4 monolayer via vacancy defects, atomic adsorption and atomic doping
8天前
已完结
Surface plasmon effect combined with S-scheme charge migration in flower-like Ag/Ag6Si2O7/Bi12O17Cl2 enables efficient photocatalytic antibiotic degradation
1个月前
已完结
Vacancy engineering for tuning electron and phonon structures of two‐dimensional materials
1个月前
已完结
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