{ "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" 4.165284737944603 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.165284737944603e-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" [ 2.92080829430611 2.65754653144026 2.63224361332189 2.62613359322013 2.68531033420995 2.59334400366104 2.60713762882869 2.72513077969991 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.92080829430611e-10 2.657546531440261e-10 2.63224361332189e-10 2.62613359322013e-10 2.68531033420995e-10 2.59334400366104e-10 2.60713762882869e-10 2.72513077969991e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.013339599725484238 1.198269660059326 1.2167534970373974 1.2605612507570183 1.2096707309613957 1.1703517053141776 1.2927411601924121 1.2641970266052207 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01333959972548424 1.198269660059326 1.216753497037397 1.260561250757018 1.209670730961396 1.170351705314178 1.292741160192412 1.264197026605221 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Au" "Au" "Au" "Au" ] } "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 ] } }