{ "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" 4.050000071525574 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.050000071525574e-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" [ 2.83686571060197 2.51517129843588 2.53190185625453 2.55475359022408 2.61439945023691 2.53664098962054 2.54449159459887 2.65118077394755 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.83686571060197e-10 2.51517129843588e-10 2.53190185625453e-10 2.55475359022408e-10 2.61439945023691e-10 2.53664098962054e-10 2.54449159459887e-10 2.65118077394755e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.01267039084506408 0.26452486735540065 0.26235715117538977 0.25950108794703863 0.24154152023257774 0.2385201896586145 0.2579350938164307 0.24392504429087986 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01267039084506408 0.2645248673554007 0.2623571511753898 0.2595010879470386 0.2415415202325777 0.2385201896586145 0.2579350938164307 0.2439250442908799 ] } "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 ] } }