{"content-origin" "Obtained from personal correspondence with Stephen Foiles on 11-12-2022" "contributor-id" "4ad03136-ed7f-4316-b586-1e94ccceb311" "description" "This is an EAM potential developed for calculations of the mechanical properties of Ni. The functional forms are the same as those used by Voter and Chen (Mater Res Soc Proc, 82 (1987), p. 175). A Morse potential describes the pair interaction. The embedding function is determined by requiring that the energy vs. volume curve reproduce a simple equation of state as described by Foiles (Phys Rev B, 32 (1985), p. 7685). The parameters of the equation of state are the lattice constant, a0 = 3.52 Å, the sublimation energy, Esub = 4.45 eV, and bulk modulus, B = 1.8037 × 10^12 erg/cm3." "developer" ["0bd1b457-8e6a-46e9-8daf-b7388550ec15" "7f1c9dc9-4185-4c36-ab0b-44056f8cbf69"] "doi" "10.25950/72b7e9dc" "domain" "openkim.org" "executables" [] "extended-id" "EAM_Dynamo_FoilesHoyt_2006_Ni__MO_776437554506_000" "funding" [{"funder-identifier" "https://doi.org/10.13039/100006234" "funder-identifier-type" "Crossref Funder ID" "funder-name" "Sandia National Laboratories" "scheme-uri" "http://doi.org/"}] "kim-api-version" "2.2" "maintainer-id" "4ad03136-ed7f-4316-b586-1e94ccceb311" "model-driver" "EAM_Dynamo__MD_120291908751_005" "potential-type" "eam" "publication-year" "2022" "source-citations" [{"abstract" "Grain boundary stiffness and mobility determine the kinetics of curvature-driven grain growth. Here the stiffness and mobility are computed using an analysis of fluctuations in the grain boundary position during molecular dynamics simulations. This work represents the first determination of grain boundary stiffness for a realistic three-dimensional system. The results indicate that the boundary stiffness for a given boundary plane has a strong dependence on the direction of the boundary distortion. The mobility deduced is comparable with that determined in previous computer simulation studies. The advantages and limitations of the fluctuation approach are discussed." "author" "Foiles, Stephen M. and Hoyt, J.J." "doi" "https://doi.org/10.1016/j.actamat.2006.03.037" "issn" "1359-6454" "journal" "Acta Materialia" "keywords" "Grain boundary, Stiffness, Mobility, Molecular dynamics" "number" "12" "pages" "3351-3357" "recordkey" "MO_776437554506_000a" "recordprimary" "recordprimary" "recordtype" "article" "title" "Computation of grain boundary stiffness and mobility from boundary fluctuations" "url" "https://www.sciencedirect.com/science/article/pii/S1359645406002333" "volume" "54" "year" "2006"}] "species" ["Ni"] "title" "EAM potential (LAMMPS cubic hermite tabulation) for Ni developed by Foiles and Hoyt (2006) v000"}