{ "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" 3.521391749382019 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.521391749382019e-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" [ 2.41734140567069 2.22209940937137 2.23450661262617 2.24438620859578 2.28150382361006 2.25647096885015 2.19808061064119 2.37476723062867 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.41734140567069e-10 2.22209940937137e-10 2.23450661262617e-10 2.24438620859578e-10 2.28150382361006e-10 2.25647096885015e-10 2.19808061064119e-10 2.37476723062867e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.022221047272247853 1.604382861848398 1.612010943054053 1.6334630640536707 1.5769891941268266 1.5566604374364044 1.5925954344168718 1.312747292003095 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02222104727224785 1.604382861848398 1.612010943054053 1.633463064053671 1.576989194126827 1.556660437436404 1.592595434416872 1.312747292003095 ] } "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 ] } }