Structure and electronic properties of Pdn clusters and their interactions with single S atom studied by density-functional theory
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry
Reference35 articles.
1. Structural, electronic, and magnetic properties ofScn(n=2–18)clusters from density functional calculations
2. Structures and magnetic moments of Nin () clusters
3. Density-functional calculations of the structure and electronic and magnetic properties of small yttrium clustersYn(n=2–17)
4. Geometries and magnetisms of the Zrn (n=2–8) clusters: The density functional investigations
5. Geometry, electronic structure, and magnetism of clusters
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1. Density functional theory studies on the structures and NO molecule adsorption and dissociation of RhmPdn (m + n = 13) clusters;Journal of Nanoparticle Research;2023-11
2. Production of Dimethyl Carbonate Using a Zirconium–Praseodymium-Based Catalyst from Methanol and Propylene Carbonate: An Experimental and DFT Study;Industrial & Engineering Chemistry Research;2023-05-01
3. Electronic structure modulation of Pdn (n = 2–5) nanoclusters in the hydrogenation of cinnamaldehyde;Chemical Communications;2023
4. Stability of Pd clusters supported on pristine, B-doped, and defective graphene quantum dots, and their reactivity toward oxygen adsorption: A DFT analysis;Solid State Sciences;2019-07
5. Theoretical study of electron transport properties of SimCn /Cn clusters tethered on graphene nanoribbon;Ceramics International;2019-01
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