{ "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" 3.6200000196695328 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.620000019669533e-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" [ 2.53785975525274 2.27791614587762 2.29178044282528 2.26767507819911 2.30413107511578 2.27445529630058 2.25087244043708 2.3861715717 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.53785975525274e-10 2.27791614587762e-10 2.29178044282528e-10 2.26767507819911e-10 2.30413107511578e-10 2.27445529630058e-10 2.25087244043708e-10 2.3861715717e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016717195093798657 0.9402004979221349 0.9406231821667501 0.9109626783554191 0.8462468061205929 0.8775296345672049 0.889210006680103 0.7653340416789055 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01671719509379866 0.9402004979221349 0.9406231821667501 0.9109626783554191 0.8462468061205929 0.8775296345672049 0.889210006680103 0.7653340416789055 ] } "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 ] } }