{ "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" 3.640646010637284 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.640646010637284e-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" [ 2.55189146414441 2.17984799869164 2.22910869656117 2.27483210436194 2.30377435453132 2.25889763015119 2.17370960097737 2.37533591234499 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.55189146414441e-10 2.17984799869164e-10 2.22910869656117e-10 2.27483210436194e-10 2.30377435453132e-10 2.25889763015119e-10 2.17370960097737e-10 2.37533591234499e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.015304197245930521 1.0086532685031098 1.0195506164386798 1.04086182055507 0.9780112355053644 1.0158163752341518 0.9988542336826167 0.8435474711680551 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01530419724593052 1.00865326850311 1.01955061643868 1.04086182055507 0.9780112355053644 1.015816375234152 0.9988542336826167 0.8435474711680551 ] } "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 ] } }