{ "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" 3.52000005543232 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.52000005543232e-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" [ 2.46566168852717 2.17578965816818 2.18333365859637 2.17275426225018 2.20110216423888 2.11594134416155 2.14627424420883 2.13607300393192 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46566168852717e-10 2.17578965816818e-10 2.18333365859637e-10 2.17275426225018e-10 2.20110216423888e-10 2.11594134416155e-10 2.14627424420883e-10 2.13607300393192e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.022057999537274556 1.4041310889782055 1.399482046500701 1.4205057200212723 1.381452117606115 1.3699973499152591 1.3489574332306713 1.383717267158573 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02205799953727456 1.404131088978205 1.399482046500701 1.420505720021272 1.381452117606115 1.369997349915259 1.348957433230671 1.383717267158573 ] } "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 ] } }