{ "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" 3.593729183077813 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.593729183077813e-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" [ 2.51837637957257 2.28411371297942 2.28770193872336 2.2490857930557 2.32697765892457 2.29024960674042 2.27085432448763 2.30279805521877 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.51837637957257e-10 2.28411371297942e-10 2.28770193872336e-10 2.2490857930557e-10 2.32697765892457e-10 2.29024960674042e-10 2.27085432448763e-10 2.30279805521877e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.020422794166492297 1.0656634133073004 1.0743844260192246 1.0838122560842893 0.9736348445221735 0.9593039525437781 0.9842243554014323 0.8447553627717399 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.0204227941664923 1.0656634133073 1.074384426019225 1.083812256084289 0.9736348445221735 0.9593039525437781 0.9842243554014323 0.8447553627717399 ] } "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 ] } }