{ "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" 4.061213478446007 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.061213478446007e-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" [ 2.85217373888462 2.54453547210427 2.59269270931084 2.60864759999144 2.5824434139232 2.63039331211009 2.57685046421714 2.51756046170187 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.85217373888462e-10 2.54453547210427e-10 2.59269270931084e-10 2.60864759999144e-10 2.582443413923201e-10 2.63039331211009e-10 2.57685046421714e-10 2.51756046170187e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.010149708419998384 0.870917399690991 0.8901975148862468 0.8951938211911609 0.845613643465806 0.8173817863726655 0.8193573707116393 0.6770772782003195 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01014970841999838 0.870917399690991 0.8901975148862468 0.8951938211911609 0.845613643465806 0.8173817863726655 0.8193573707116393 0.6770772782003195 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" ] } "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 ] } }