{ "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" 3.608429037034512 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.608429037034512e-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" [ 2.52805482673919 2.22422701291633 2.27041166268254 2.25148504924343 2.24254671543449 2.25078827646054 2.17202899967489 2.25727620995262 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.52805482673919e-10 2.22422701291633e-10 2.27041166268254e-10 2.25148504924343e-10 2.24254671543449e-10 2.25078827646054e-10 2.17202899967489e-10 2.25727620995262e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.020218298721470088 0.9206154914547149 0.8832221822676394 0.9258927273874642 0.7918119078613449 0.8992230920882555 0.6560988799336909 0.6089118804341194 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02021829872147009 0.9206154914547149 0.8832221822676394 0.9258927273874642 0.7918119078613449 0.8992230920882555 0.6560988799336909 0.6089118804341194 ] } "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 ] } }