{ "content-origin" "NIST IPRP (https://www.ctcms.nist.gov/potentials/Ni.html)" "content-other-locations" "http://homepages.ed.ac.uk/graeme/moldy/moldy.html" "contributor-id" "360c0aed-48ce-45f6-ba13-337f12a531e8" "description" "Finnis-Sinclair potential for Ni developed by Ackland et al. (1987). The total energy is regarded as consisting of a pair-potential part and a many body cohesive part. Both these parts are functions of the atomic separations only and are represented by cubic splines, fitted to various bulk properties. Using this potential, point defects, surfaces (including the surface reconstructions) and grain boundaries have been studied and satisfactory agreement with available experimental data has been found.\n\nIn version 2 of the potential, according to the developer Graeme Ackland (as reported in the NIST IPRP), close-range repulsion has been added for radiation studies. The previous version of the potential is available in OpenKIM, see https://openkim.org/cite/MO_977363131043_004" "developer" [ "c3e36b7f-82b0-46cb-9af3-94f80655331e" "752f5d1f-4b9f-4955-9733-b1bc0164fc14" "c1e33953-aaba-4843-a770-b4b23bf344b1" "0ce06029-a063-41f7-93e6-1910e50186d0" ] "doi" "10.25950/37ebcbaa" "domain" "openkim.org" "extended-id" "EAM_Dynamo_AcklandTichyVitek_1987v2_Ni__MO_769632475533_000" "kim-api-version" "2.0" "maintainer-id" "360c0aed-48ce-45f6-ba13-337f12a531e8" "model-driver" "EAM_Dynamo__MD_120291908751_005" "potential-type" "eam" "publication-year" "2018" "source-citations" [ { "author" "Ackland, G. J. and Tichy, G. and Vitek, V. and Finnis, M. W." "doi" "10.1080/01418618708204485" "journal" "Philosophical Magazine A" "number" "6" "pages" "735-756" "recordkey" "MO_769632475533_000a" "recordprimary" "recordprimary" "recordtype" "article" "title" "Simple {N}-body potentials for the noble metals and nickel" "volume" "56" "year" "1987" } ] "species" [ "Ni" ] "title" "Finnis-Sinclair potential (LAMMPS cubic hermite tabulation) for Ni developed by Ackland et al. (1987), version 2 refitted for radiation studies v000" }