Surface Energy Calculation of Face Centered Cubic Lattice Metals

Recently, the total energies of metals have been calculated by the embedded atom method (EAM) which deals with interatomic binding energies based on many body interactions. Since the development of the personal computer makes it possible to execute the EAM calculation in a short time, the surface en...

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Veröffentlicht in:Journal of Chemical Software 1996/10/31, Vol.3(2), pp.91-96
Hauptverfasser: URANO, Yasuhisa, NOGUCHI, Fumio, MIURA, Hiroshi
Format: Artikel
Sprache:eng ; jpn
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