{ "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" 3.620386697351933 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.620386697351933e-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" [ 2.53585592927828 2.29058581224703 2.29410634897732 2.2869647240927 2.27903184167918 2.27012696367229 2.24915731686752 2.28470675688778 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.53585592927828e-10 2.29058581224703e-10 2.29410634897732e-10 2.2869647240927e-10 2.27903184167918e-10 2.27012696367229e-10 2.24915731686752e-10 2.28470675688778e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016673865261681162 0.96551993659459 0.9782672863342452 0.9741863189558585 0.8558121360268502 0.8677703688041063 0.9585889547124476 0.928567555783908 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01667386526168116 0.96551993659459 0.9782672863342452 0.9741863189558585 0.8558121360268502 0.8677703688041063 0.9585889547124476 0.928567555783908 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Cu" "Cu" "Cu" "Cu" ] } "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 ] } }