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1710 积分 2022-07-15 加入
Comparison between Gaussian-type orbitals and plane wave ab initio density functional theory modeling of layer silicates: Talc [Mg3Si4O10(OH)2] as model system
17天前
已完结
Density Functional Theory Study of Pyrophyllite and M-Montmorillonites (M = Li, Na, K, Mg, and Ca): Role of Dispersion Interactions
17天前
已完结
Molecular dynamics simulation of nanocolloidal amorphous silica particles: Part I
9个月前
已完结
New insights into adsorption mechanism of sodium oleate on the cassiterite (110) surface and its stability behavior under temperature: An approach combining quantum and molecular mechanics
9个月前
已完结
Water Adsorption on the Reconstructed (001) Chalcopyrite Surfaces
10个月前
已完结
Reconstruction of the Chalcopyrite Surfaces—A DFT Study
10个月前
已完结
Catalytic CO2 Capture via Ultrasonically Activating Dually Functionalized Carbon Nanotubes
11个月前
已完结
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