{ "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" 2.863657310605049 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.863657310605049e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.44907000274447 2.31115054807798 2.24885319452093 2.23963885855934 2.23628282280168 2.29620352391816 2.30942157011023 2.37775691222308 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.44907000274447e-10 2.31115054807798e-10 2.24885319452093e-10 2.23963885855934e-10 2.23628282280168e-10 2.29620352391816e-10 2.30942157011023e-10 2.37775691222308e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016148349987012665 1.1220332221736293 1.1283289641688126 1.140717763378512 1.0930315543990006 0.9855278724979063 0.8944726995876813 0.3685754092125004 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01614834998701267 1.122033222173629 1.128328964168813 1.140717763378512 1.093031554399001 0.9855278724979063 0.8944726995876813 0.3685754092125004 ] } "short-name" { "source-value" [ "bcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Fe" "Fe" "Fe" "Fe" ] } "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 ] } }