{ "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" 4.080191016197205 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.080191016197205e-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" [ 2.85921812190974 2.61429952151684 2.59128933695096 2.61899724013622 2.64499416641121 2.61600006853523 2.57053195251931 2.69523463666396 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.85921812190974e-10 2.61429952151684e-10 2.59128933695096e-10 2.61899724013622e-10 2.64499416641121e-10 2.61600006853523e-10 2.57053195251931e-10 2.69523463666396e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.014573840703282997 0.5788253382857823 0.5753745427915326 0.5689198176573204 0.5316390400442548 0.5100070716760732 0.5482441795547592 0.5601463176159234 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.014573840703283 0.5788253382857823 0.5753745427915326 0.5689198176573204 0.5316390400442548 0.5100070716760732 0.5482441795547592 0.5601463176159234 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Au" "Au" "Au" "Au" ] } "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 ] } }