{ "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" 2.850998893380165 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.850998893380165e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.43893839798784 2.32643207969839 2.33551989754372 2.31724730670662 2.28367452437191 2.3219055630444 2.32495815126005 2.39297164917864 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.43893839798784e-10 2.32643207969839e-10 2.33551989754372e-10 2.31724730670662e-10 2.28367452437191e-10 2.3219055630444e-10 2.32495815126005e-10 2.39297164917864e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.01625408149469076 0.9114664786725 0.9249612476291984 0.9066330002885923 0.8903318305774298 0.7976090752893155 0.6881762289610244 0.2827749683508656 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01625408149469076 0.9114664786725 0.9249612476291984 0.9066330002885923 0.8903318305774298 0.7976090752893155 0.6881762289610244 0.2827749683508656 ] } "short-name" { "source-value" [ "bcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Fe" "Fe" ] } "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 ] } }