{ "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" 2.860195450484753 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.860195450484753e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.44713576244763 2.24393930430322 2.27292490695663 2.2253105680594 2.24809234649257 2.26863065538436 2.25539314768629 2.34003954445505 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.44713576244763e-10 2.24393930430322e-10 2.27292490695663e-10 2.2253105680594e-10 2.24809234649257e-10 2.26863065538436e-10 2.25539314768629e-10 2.34003954445505e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016149738195816735 1.311803119709652 1.3079887046133627 1.4137283690626037 1.3327776139189627 1.103743337356726 1.0283523021127208 0.39083640595109537 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01614973819581673 1.311803119709652 1.307988704613363 1.413728369062604 1.332777613918963 1.103743337356726 1.028352302112721 0.3908364059510954 ] } "short-name" { "source-value" [ "bcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Fe" "Fe" "Fe" "Fe" ] } "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 ] } }