{ "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" 4.044650807976723 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.044650807976723e-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" [ 2.83322028926864 2.53485881870157 2.5536497419289 2.53496264517896 2.62411745140111 2.51090661795365 2.52096564169787 2.66161612044689 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.83322028926864e-10 2.53485881870157e-10 2.5536497419289e-10 2.53496264517896e-10 2.62411745140111e-10 2.51090661795365e-10 2.52096564169787e-10 2.66161612044689e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.012708519436312822 0.6169191006842535 0.6213459709217353 0.6265436974551172 0.6217357452392449 0.6273132820823175 0.6312834310060286 0.5225120001550909 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01270851943631282 0.6169191006842535 0.6213459709217353 0.6265436974551172 0.6217357452392449 0.6273132820823175 0.6312834310060286 0.5225120001550909 ] } "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 ] } }