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Translational dependence of the geometry of metallic mono- and bilayers optimized on semi-ionic supports: the cases of Pd on γ-Al2O3(110), monoclinic ZrO2(001), and rutile TiO2(001)
Abstract
Geometries and cohesion energies while shifting (by 1 Å)/optimizing the Pd 24 monolayer (2 × 2 unit cells) at γ-Al 2 O 3 (110) along the O X...
Paper Details
Title
Translational dependence of the geometry of metallic mono- and bilayers optimized on semi-ionic supports: the cases of Pd on γ-Al2O3(110), monoclinic ZrO2(001), and rutile TiO2(001)
Published Date
Jan 1, 2022
Journal
Volume
24
Issue
1
Pages
143 - 155
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