{ "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" 3.519999980926514 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.519999980926514e-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" [ 2.46966892979954 2.15094061103664 2.2149760028637 2.21612486733176 2.23243214706006 2.21148962082639 2.1365665098957 2.31398954899245 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46966892979954e-10 2.15094061103664e-10 2.2149760028637e-10 2.21612486733176e-10 2.23243214706006e-10 2.21148962082639e-10 2.1365665098957e-10 2.31398954899245e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.022238072369713452 1.4746942337788653 1.4669506719932546 1.5182882266578337 1.443834168791259 1.469318354996973 1.4419188010586792 1.2851226891237968 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02223807236971345 1.474694233778865 1.466950671993255 1.518288226657834 1.443834168791259 1.469318354996973 1.441918801058679 1.285122689123797 ] } "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 ] } }