{ "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" 3.6149601638317113 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.614960163831711e-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" [ 2.53379989988805 2.2936222998901 2.29721502396291 2.27751328351391 2.36700003129573 2.32449648096124 2.31534813236101 2.36575790583702 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.53379989988805e-10 2.2936222998901e-10 2.29721502396291e-10 2.27751328351391e-10 2.36700003129573e-10 2.32449648096124e-10 2.31534813236101e-10 2.36575790583702e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016722186394541077 0.7772888516544217 0.78802211655369 0.7919575515462427 0.7533953564295758 0.7469306493125594 0.7656746423997889 0.8144209243553452 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01672218639454108 0.7772888516544217 0.78802211655369 0.7919575515462427 0.7533953564295758 0.7469306493125594 0.7656746423997889 0.8144209243553452 ] } "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 ] } }