{
    "contributor-id" "8283ed9e-ec2a-491a-83e4-ec93eae4139e" 
    "description" "The potential is based on the rigid-ion Born model of ionic solid. The Ti and O ions interact via long-range Coulombic interactions and short-range Buckingham interactions. The parameters were fitted so that they give good agreement with the crystal structures of anatase, rutile and brookite." 
    "developer" [
        "e738a9aa-4142-4507-8be9-e9dc0d766f4c" 
        "5cf7089c-d835-41fe-a41b-c68789ef5b2a"
    ] 
    "doi" "10.25950/cfc442b6" 
    "domain" "openkim.org" 
    "executables" [] 
    "extended-id" "Sim_LAMMPS_Buckingham_MatsuiAkaogi_1991_TiO__SM_690504433912_000" 
    "funding" [
        {
            "award-number" "814572" 
            "award-title" " Innovative Nanoinformatics models and tools: towards a Solid, verified and Integrated Approach to Predictive (eco)Toxicology (NanoSolveIT)" 
            "award-uri" "https://cordis.europa.eu/project/id/814572" 
            "funder-name" "EU H2020"
        }
    ] 
    "implementer" [
        "8283ed9e-ec2a-491a-83e4-ec93eae4139e"
    ] 
    "kim-api-version" "2.2" 
    "maintainer-id" "8283ed9e-ec2a-491a-83e4-ec93eae4139e" 
    "potential-type" "buckingham" 
    "publication-year" "2021" 
    "run-compatibility" "portable-models" 
    "simulator-name" "LAMMPS" 
    "simulator-potential" "buck/coul/long" 
    "source-citations" [
        {
            "author" "M. Matsui and M. Akaogi" 
            "doi" "10.1080/08927029108022432" 
            "journal" "Molecular Simulation" 
            "number" "4-6" 
            "pages" "239-244" 
            "recordkey" "SM_690504433912_000a" 
            "recordprimary" "recordprimary" 
            "recordtype" "article" 
            "title" "Molecular Dynamics Simulation of the Structural and Physical Properties of the Four Polymorphs of {T}i{O}$_2$" 
            "volume" "6" 
            "year" "1991"
        }
    ] 
    "species" [
        "Ti" 
        "O"
    ] 
    "title" "LAMMPS Buckingham potential for TiO2 developed by Matsui and Akaogi (1991) v000"
}