{ "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" 3.620000052452088 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.620000052452088e-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" [ 2.53659292444397 2.28053859706615 2.32545647063315 2.32139454706592 2.38407300700552 2.32658170687453 2.31529514893054 2.41200541310008 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.53659292444397e-10 2.28053859706615e-10 2.32545647063315e-10 2.32139454706592e-10 2.38407300700552e-10 2.32658170687453e-10 2.31529514893054e-10 2.41200541310008e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016723858125674007 0.8128328525842372 0.8102898783826865 0.8254694778403636 0.7781432217227479 0.7789028821907762 0.8158227602713533 0.6753989009068844 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01672385812567401 0.8128328525842372 0.8102898783826865 0.8254694778403636 0.7781432217227479 0.7789028821907762 0.8158227602713533 0.6753989009068844 ] } "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 ] } }