{ "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" 4.210718545317654 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.210718545317654e-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" [ 2.94704660400904 2.69744749296086 2.7079403619282 2.72692671187525 2.77439569418548 2.72415799444712 2.67667633255456 2.69140824995943 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.94704660400904e-10 2.69744749296086e-10 2.7079403619282e-10 2.72692671187525e-10 2.77439569418548e-10 2.72415799444712e-10 2.67667633255456e-10 2.69140824995943e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.012652495850688847 0.1930029473247133 0.1835879619854981 0.17786030628933847 0.15974843683510415 0.1684221876184421 0.17416552314750586 0.13204756143888832 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01265249585068885 0.1930029473247133 0.1835879619854981 0.1778603062893385 0.1597484368351041 0.1684221876184421 0.1741655231475059 0.1320475614388883 ] } "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 ] } }