Comparative analysis of geometry, relative stabilities, optoelectronic and thermochemical properties of [CuX+2]λ and [CuX-Ag-Au]λ nanoalloy clusters (λ = 0, ± 1; X = 1 − 13): a DFT approach
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DOI: 10.1038/s41598-025-23559-x
Abstract: A comparative study of geometry, relative stabilities, optoelectronic and thermochemical properties of [CuX-Ag-Au]λ and [CuX+2]λ (λ = 0, ± 1; X = 1 − 13) nanoalloy clusters is performed by using density functional theory (DFT) technique. The ground state configuration as well… read more here.
Keywords: value; energy; thermochemical properties; cux cux ... See more keywords