CO2 adsorption and activation on AuO(CO2)nā/+ (n = 1ā3) clusters: a theoretical study
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DOI: 10.1039/d5ra04472c
Abstract: The geometric and electronic properties of AuO(CO2)nā/+ (n = 1ā3) clusters have been systematically investigated using density functional theory (DFT). All anionic ground states are singlets, whereas the cationic counterparts are triplets. Anions prefer distorted… read more here.
Keywords: auo co2; activation auo; co2; co2 adsorption ... See more keywords