{ "property-id" "tag:brunnels@noreply.openkim.org,2016-02-18:property/grain-boundary-symmetric-tilt-energy-relaxed-relation-cubic-crystal" "instance-id" 1 "a" { "source-value" 3.5200000256299973 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.520000025629997e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "minimum-atom-separation" { "source-value" [ 2.46734021373317 2.24312349151933 2.24443219377888 2.21313640581898 2.27785084520238 2.23190531555058 2.1945619477886 2.21910718789893 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46734021373317e-10 2.24312349151933e-10 2.24443219377888e-10 2.21313640581898e-10 2.27785084520238e-10 2.23190531555058e-10 2.1945619477886e-10 2.21910718789893e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02217265115891366 1.3194665695509444 1.3282204337830466 1.3115717898258976 1.2169430212100463 1.253950580940397 1.3151954569028836 1.365124809474723 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02217265115891366 1.319466569550944 1.328220433783047 1.311571789825898 1.216943021210046 1.253950580940397 1.315195456902884 1.365124809474723 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Ni" "Ni" "Ni" "Ni" ] } "tilt-angle" { "source-value" [ 0.0 24.43269767945453 27.79577249602797 32.20422750397202 38.21321070173819 46.82644889274107 52.659006983369785 59.99999999999999 ] "source-unit" "degrees" "si-unit" "radian" "si-value" [ 0.0 0.4264310196508597 0.4851277481909706 0.562069803005627 0.6669463445036643 0.8172757101951847 0.9190730526904897 1.047197551196598 ] } "tilt-axis" { "source-value" [ 1 1 1 ] } }