{ "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" 3.524220451712608 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.524220451712608e-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" [ 2.47279451410759 2.26501285933039 2.23160203077072 2.21030387096305 2.24148341498776 2.23575925272066 2.18341207695038 2.27879542213908 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.47279451410759e-10 2.26501285933039e-10 2.23160203077072e-10 2.21030387096305e-10 2.24148341498776e-10 2.23575925272066e-10 2.18341207695038e-10 2.27879542213908e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02216197896488812 1.323789199581654 1.3241447649994436 1.335064829217808 1.2804568112718568 1.2826944410507106 1.3966278931730436 1.262543066160887 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02216197896488812 1.323789199581654 1.324144764999444 1.335064829217808 1.280456811271857 1.282694441050711 1.396627893173044 1.262543066160887 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Ni" "Ni" "Ni" "Ni" ] } "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 ] } }