{ "content-origin" "LAMMPS package 22-Sep-2017" "contributor-id" "360c0aed-48ce-45f6-ba13-337f12a531e8" "description" "This is a LAMMPS Angular Dependent Potential (ADP) for Ni ('pair_style adp' with potential file Ni.adp). The potential is based on the embedded-atom method (EAM) but additionally includes a bond-angle dependence. In comparison with the existing modified EAM method, this potential form is simpler, extends interactions to several (3-5) coordination shells and replaces the screening procedure by a smooth cutoff of the potential functions. Note that data below r=1.5 A is extrapolated; F(rho) data not extrapolated." "developer" [ "201572cf-870c-477f-b34f-3a6481002dee" "061c584a-da33-4561-a03d-fab52dae81dd" "7a040620-c466-4980-8f46-e243b395e117" ] "doi" "10.25950/dd7328e8" "domain" "openkim.org" "extended-id" "Sim_LAMMPS_ADP_MishinMehlPapaconstantopoulos_2005_Ni__SM_477692857359_000" "kim-api-version" "2.1" "maintainer-id" "360c0aed-48ce-45f6-ba13-337f12a531e8" "potential-type" "adp" "publication-year" "2019" "run-compatibility" "portable-models" "simulator-name" "LAMMPS" "simulator-potential" "adp" "source-citations" [ { "author" "Mishin, Y. and Mehl, M.J. and Papaconstantopoulos, D.A." "doi" "10.1016/j.actamat.2005.05.001" "journal" "Acta Materialia" "number" "15" "pages" "4029--4041" "recordkey" "SM_477692857359_000a" "recordprimary" "recordprimary" "recordtype" "article" "title" "Phase stability in the Fe\u2013Ni system: Investigation by first-principles calculations and atomistic simulations" "volume" "53" "year" "2005" } ] "species" [ "Ni" ] "title" "LAMMPS ADP Potential for Ni developed by Mishin et al. (2005) v000" }