{ "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" 4.040926471352577 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.040926471352577e-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" [ 2.83168657988201 2.53438313443104 2.55093364355883 2.52443680799236 2.64478483081783 2.54077156724868 2.48502161211002 2.5871925190258 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.83168657988201e-10 2.53438313443104e-10 2.55093364355883e-10 2.52443680799236e-10 2.64478483081783e-10 2.54077156724868e-10 2.48502161211002e-10 2.5871925190258e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.014762949629979141 0.5695736135288927 0.5743689910601666 0.5728072190484864 0.5293839303265074 0.5312413759159521 0.6047800781015805 0.6050558131199254 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01476294962997914 0.5695736135288927 0.5743689910601666 0.5728072190484864 0.5293839303265074 0.5312413759159521 0.6047800781015805 0.6050558131199254 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" ] } "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 ] } }