{ "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" 3.6133156493306164 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.613315649330617e-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" [ 2.53365503344993 2.27532660331101 2.28406711196783 2.27596219432932 2.31425352232552 2.30088963820115 2.27665566071302 2.33140320846732 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.53365503344993e-10 2.27532660331101e-10 2.28406711196783e-10 2.27596219432932e-10 2.31425352232552e-10 2.30088963820115e-10 2.27665566071302e-10 2.33140320846732e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016778365758932018 1.0479519692379193 1.0645377586208429 1.0470865698112664 1.0074928237404521 0.9906720241480084 1.02682243004874 0.9480648011376704 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01677836575893202 1.047951969237919 1.064537758620843 1.047086569811266 1.007492823740452 0.9906720241480084 1.02682243004874 0.9480648011376704 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Cu" "Cu" "Cu" "Cu" ] } "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 ] } }