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52 积分 2025-10-14 加入
Computational roadmap of stable Mo–S nanoclusters: atomic structures and magic compositions
8天前
已完结
Quantum chemical design and prediction that complements understanding: How do the transition metals enhance the CO2 sensing ability of inorganic Mg12O12 nanoclusters?
8天前
已完结
DFT investigation on electronic properties of the first principle three models of titanium-zirconium nanoclusters doped with two molecules of gallium-arsenic
8天前
已完结
A theoretical study of the monolayer-protected gold cluster Au317(SR)110
8天前
已完结
Investigation on the electronic detection of letrozole drug in gas and solvent phases by metal oxide nanoclusters
8天前
已关闭
Investigations of chemical sensing properties of Al24N24, B24N24, and B24P24 nanoclusters toward carbamazepine: A DFT study
8天前
已完结
In situ self-growing CuO nanoclusters on titanium dioxide for high-efficient photocatalytic degradation of norfloxacin under visible light
22天前
已完结
A consistent and accurateab initioparametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
1个月前
已完结
A model for the ethylene and acetylene adsorption on the surface of Cun(n = 10–15) nanoclusters: A theoretical study
1个月前
已完结
Adsorption of He gas on the Agn nanoclusters: A molecular dynamic study
1个月前
已完结