{ "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" 4.032082714140415 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.032082714140415e-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" [ 2.82407394159368 2.54002452556581 2.58688909959528 2.54031318832237 2.57479871285578 2.59074951751222 2.52127141181098 2.56539567016031 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.82407394159368e-10 2.54002452556581e-10 2.58688909959528e-10 2.54031318832237e-10 2.57479871285578e-10 2.59074951751222e-10 2.52127141181098e-10 2.56539567016031e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.012757860942141257 0.5281456561824404 0.5112816309367352 0.5195806528688621 0.5037457439825591 0.49025049956491046 0.5345832661784592 0.46704875414773683 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01275786094214126 0.5281456561824404 0.5112816309367352 0.5195806528688621 0.5037457439825591 0.4902504995649105 0.5345832661784592 0.4670487541477368 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" ] } "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 ] } }