{ "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" 2.8665045946836467 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.866504594683647e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.45127853480023 2.26231780793129 2.23191574579458 2.22824428735895 2.26045263560568 2.25446596477471 2.27567245386079 2.32959392047574 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.45127853480023e-10 2.26231780793129e-10 2.23191574579458e-10 2.22824428735895e-10 2.26045263560568e-10 2.25446596477471e-10 2.27567245386079e-10 2.32959392047574e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.05215124927484081 1.4842350853881914 1.5553807417898342 1.5859530120049408 1.462158493307026 1.333203591847355 1.149452870408971 0.45849826262679527 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.05215124927484081 1.484235085388191 1.555380741789834 1.585953012004941 1.462158493307026 1.333203591847355 1.149452870408971 0.4584982626267953 ] } "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 ] } }