{ "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" [ 2.4682208993655 2.21873346966322 2.22442673624718 2.21875993789811 2.23499455434275 2.22288859151211 2.17216170183538 2.21783436941754 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.4682208993655e-10 2.21873346966322e-10 2.22442673624718e-10 2.21875993789811e-10 2.23499455434275e-10 2.22288859151211e-10 2.17216170183538e-10 2.21783436941754e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02215512848386332 1.6037555480635852 1.6316531446566835 1.636464705406018 1.5572610912130056 1.5554014632804851 1.6314378062065973 1.6288736036958587 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02215512848386332 1.603755548063585 1.631653144656684 1.636464705406018 1.557261091213006 1.555401463280485 1.631437806206597 1.628873603695859 ] } "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 ] } }