{ "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" 2.8886456787586208 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.888645678758621e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.47145571697323 2.27571425469441 2.29600955942426 2.25759621641289 2.30288690668892 2.28513356605845 2.27704678447108 2.35902827757517 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.47145571697323e-10 2.27571425469441e-10 2.29600955942426e-10 2.25759621641289e-10 2.30288690668892e-10 2.28513356605845e-10 2.27704678447108e-10 2.35902827757517e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.015458282873956546 1.3315245366085777 1.309308126335396 1.34791122892877 1.2669543312363167 1.099793300886946 1.0151128470764816 0.3896895704683953 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01545828287395655 1.331524536608578 1.309308126335396 1.34791122892877 1.266954331236317 1.099793300886946 1.015112847076482 0.3896895704683953 ] } "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 ] } }