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A Local View of Bonding and Diffusion at Metal Surfaces
[chapter]
1997
Surface Diffusion
First-principles density functional calculations and corresponding experimental results underline the importance of basic chemical concepts, such as coordination, valence saturation and promotion-hybridization energetics, in understanding bonding and difision of atoms at and on metal suqaces. Several examples are reviewed, including outer-layer relaxations of clean hcp(0001) surfaces, liquid-metal-embrittlement energetics, separation energies of metal-adatom dimers, concerted substitutional
doi:10.1007/978-1-4899-0262-7_2
fatcat:x6aj6k4xfffjbhvxwoxq43cnde