{ "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" [ 2.46854036154768 2.21308819570131 2.21259228211263 2.2083545334407 2.21364417309821 2.19791266094589 2.15834372538939 2.19916027490389 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46854036154768e-10 2.21308819570131e-10 2.21259228211263e-10 2.2083545334407e-10 2.21364417309821e-10 2.19791266094589e-10 2.15834372538939e-10 2.19916027490389e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02215512848506267 1.4677870133996787 1.4655011396838624 1.460900342701798 1.3636215269487701 1.311860444901081 1.4601431382959573 1.3733042338113925 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02215512848506267 1.467787013399679 1.465501139683862 1.460900342701798 1.36362152694877 1.311860444901081 1.460143138295957 1.373304233811393 ] } "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 ] } }