Intermetallic Compounds of the Heaviest Elements: The Electronic Structure and Bonding of Dimers of Element 112 and its Homolog Hg

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Pershina, V
Bastug, Turgut
Jacob, T
Fricke, B
Varga, S

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Elsevier

Abstract

Fully relativistic (four-component) density-functional calculations were performed for the element 112 dimers (112)X (X = Pd, Cu, Ag and Au) and those of its lighter homolog, Hg. A relatively small decrease of about 15-20 kJ/mol in bonding was found from

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Chemical Physics Letters

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2037-12-31