{ "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" 3.615000367164612 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.615000367164612e-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" [ 2.53379126024236 2.13715526358891 2.17834105271112 2.1167091991995 2.16189353942889 2.08282444697523 2.1424340789004 2.14427663944187 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.53379126024236e-10 2.13715526358891e-10 2.17834105271112e-10 2.1167091991995e-10 2.16189353942889e-10 2.08282444697523e-10 2.1424340789004e-10 2.14427663944187e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016617839701633753 1.0251321257007249 1.0361147719724373 1.0704667826742928 1.0078046122540143 1.0086087704513198 0.9862359234038571 0.9773928546230176 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01661783970163375 1.025132125700725 1.036114771972437 1.070466782674293 1.007804612254014 1.00860877045132 0.9862359234038571 0.9773928546230176 ] } "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 ] } }