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- W2090784005 abstract "We study the structure of the reconstructed Au (100) surface, using a phenomenological Hamiltonian, including a many-body force term (the glue), carefully optimized to account for a vast variety of properties of solid and liquid gold. The optimal atomic configuration of (100) slabs is obtained by a molecular-dynamics strategy. We find that the glue term drives the reconstruction into a denser, quasitriangular surface layer. By variation of cell size and atom number, the lowest-energy configuration is found to be roughly (1ifmmodetimeselsetexttimesfi{}5), and more precisely (34ifmmodetimeselsetexttimesfi{}5), close to (26ifmmodetimeselsetexttimesfi{}48) suggested by experiment." @default.
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- W2090784005 date "1986-08-11" @default.
- W2090784005 modified "2023-10-09" @default.
- W2090784005 title "Au (100) Surface Reconstruction" @default.
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- W2090784005 doi "https://doi.org/10.1103/physrevlett.57.719" @default.
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