{ "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" 3.613315634429455 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.613315634429455e-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" [ 2.53365478166227 2.27880873257682 2.28340134912299 2.29827956630935 2.31418373095232 2.30285553598368 2.27665893990171 2.38654317719647 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.53365478166227e-10 2.27880873257682e-10 2.28340134912299e-10 2.29827956630935e-10 2.31418373095232e-10 2.30285553598368e-10 2.27665893990171e-10 2.38654317719647e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016778365126115465 1.054289230209881 1.0552898048896555 1.046964832335097 1.0074928103251721 0.9906720028193836 1.0268213912461754 0.9202310034456155 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01677836512611547 1.054289230209881 1.055289804889656 1.046964832335097 1.007492810325172 0.9906720028193836 1.026821391246175 0.9202310034456155 ] } "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 ] } }