Determination of parameters in n-body interaction potentials by embedded function

1994 
A new potential form and parameters for embedded atom method are proposed. It is consisted of simple functions with five parameters and is smoothly truncated between 3rd and 4th nearest neighbor distance. Those parameters can be determined uniquely from the experimental values of crystals. These potentials may be used in molecular dynamics simulations for a large atomic system efficiently.
    • Correction
    • Source
    • Cite
    • Save
    • Machine Reading By IdeaReader
    4
    References
    0
    Citations
    NaN
    KQI
    []