{ "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" 4.077997982501984 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.077997982501984e-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" [ 2.85726588385299 2.59800674957217 2.59428547343403 2.61507708370935 2.65869313351838 2.63036549129297 2.5928900647878 2.63929356771076 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.85726588385299e-10 2.59800674957217e-10 2.59428547343403e-10 2.61507708370935e-10 2.65869313351838e-10 2.63036549129297e-10 2.5928900647878e-10 2.63929356771076e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.014588007832419687 0.6468725858167472 0.6468129129556527 0.6411604877696678 0.6099760842365742 0.5850127116544258 0.6191750613960258 0.6568951817933697 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01458800783241969 0.6468725858167472 0.6468129129556527 0.6411604877696678 0.6099760842365742 0.5850127116544258 0.6191750613960258 0.6568951817933697 ] } "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 ] } }