{ "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" 3.614959037303926 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.614959037303926e-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" [ 2.53459672580081 2.28027154354709 2.34442909534044 2.33338446064208 2.34512308949737 2.34801116805804 2.34206494534104 2.44245840205737 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.53459672580081e-10 2.28027154354709e-10 2.34442909534044e-10 2.33338446064208e-10 2.34512308949737e-10 2.34801116805804e-10 2.34206494534104e-10 2.44245840205737e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.01688667271477211 0.774825005702108 0.7881741504028883 0.801148590743931 0.7579383066737725 0.7629031068094725 0.7536006809001655 0.6800481067735313 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01688667271477211 0.774825005702108 0.7881741504028883 0.801148590743931 0.7579383066737725 0.7629031068094725 0.7536006809001655 0.6800481067735313 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Cu" "Cu" "Cu" "Cu" ] } "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 ] } }