{ "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" 3.5200000256299973 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.520000025629997e-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" [ 2.46565923569805 2.17579154856536 2.15498707341628 2.17732962469252 2.20110212186405 2.11594863350459 2.14530174103799 2.13703347666115 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46565923569805e-10 2.17579154856536e-10 2.15498707341628e-10 2.17732962469252e-10 2.20110212186405e-10 2.11594863350459e-10 2.14530174103799e-10 2.13703347666115e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02217032841274274 1.4043150267286604 1.4021080025303558 1.423411476555724 1.3815713866450592 1.370009646807017 1.3491307876034933 1.3838221169664346 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02217032841274274 1.40431502672866 1.402108002530356 1.423411476555724 1.381571386645059 1.370009646807017 1.349130787603493 1.383822116966435 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Ni" "Ni" "Ni" "Ni" ] } "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 ] } }