{"atom-type-labels" {"CaC" "Ca" "CaS" "IGNORE" "FC" "F" "FS" "IGNORE"}
 "contributor-id" "4ad03136-ed7f-4316-b586-1e94ccceb311"
 "description" "This is a LAMMPS adiabatic core/shell model tested for simulations of F- diffusion in CaF2, developed by Mitchell and Fincham in 1993. The version with x=0.1 (shell mass fraction) is used."
 "developer" ["39ff41f9-8725-4d9a-9909-4f940dbbda0e"
              "740b9a51-f930-40dd-9ae7-4b8d2d4e9bf1"]
 "disclaimer" "This Simulator Model initializes and provides parameters for pair and bonded interactions, as well as charges and masses. The user must define core/shell atom groups and the required temp/cs compute and thermostat fix_modify."
 "doi" "10.25950/8944bd95"
 "domain" "openkim.org"
 "executables" []
 "extended-id" "Sim_LAMMPS_CoreShell_MitchellFincham_1993_CaF__SM_676649151762_000"
 "kim-api-version" "2.3"
 "maintainer-id" "4ad03136-ed7f-4316-b586-1e94ccceb311"
 "potential-type" "cs"
 "publication-year" "2023"
 "run-compatibility" "special-purpose-models"
 "simulator-name" "LAMMPS"
 "simulator-potential" "born/coul/long/cs"
 "source-citations" [{"author" "Mitchell, P. J. and Fincham, David"
                      "doi" "10.1088/0953-8984/5/8/006"
                      "journal" "Journal of Physics: Condensed Matter"
                      "number" "8"
                      "pages" "1031"
                      "publisher" "IOP Publishing"
                      "recordkey" "SM_676649151762_000a"
                      "recordprimary" "recordprimary"
                      "recordtype" "article"
                      "title" "Shell model simulations by adiabatic dynamics"
                      "volume" "5"
                      "year" "1993"}]
 "species" ["Ca" "F"]
 "title" "LAMMPS adiabatic core-shell model for the Ca-F system developed by Mitchell and Fincham (1993) v000"}