{ "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" 3.604343503713608 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.604343503713608e-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" [ 2.52595859148536 2.23083506545035 2.30145044102363 2.28838152530102 2.25916488268733 2.26267248887318 2.18443179568002 2.40714878363312 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.52595859148536e-10 2.23083506545035e-10 2.30145044102363e-10 2.28838152530102e-10 2.25916488268733e-10 2.26267248887318e-10 2.18443179568002e-10 2.40714878363312e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02022493737705643 -0.6606372620564883 0.7300734640043048 0.8365738259249059 0.7724764549403297 0.7791450953011946 -0.9826540732770572 0.39129293380676833 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02022493737705643 -0.6606372620564883 0.7300734640043048 0.8365738259249059 0.7724764549403297 0.7791450953011946 -0.9826540732770572 0.3912929338067683 ] } "short-name" { "source-value" [ "fcc" ] } "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 ] } }