{ "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" 4.061213478446007 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.061213478446007e-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" [ 2.84443326247281 2.54848757133773 2.56137084375474 2.5507280547043 2.59985868314926 2.57434709750919 2.56128206503768 2.6896716745722 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.84443326247281e-10 2.54848757133773e-10 2.56137084375474e-10 2.5507280547043e-10 2.59985868314926e-10 2.57434709750919e-10 2.56128206503768e-10 2.6896716745722e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.01010686538484258 0.8611104080408601 0.8564158072134154 0.8802772879051562 0.8271120375678633 0.7788974354349787 0.8011813644452518 0.726565620159176 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01010686538484258 0.8611104080408601 0.8564158072134154 0.8802772879051562 0.8271120375678633 0.7788974354349787 0.8011813644452518 0.726565620159176 ] } "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 ] } }