{ "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" 3.6133156493306164 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.613315649330617e-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" [ 2.53365503344992 2.27532660331271 2.28406711196761 2.27596219432934 2.31425352232552 2.30088963820115 2.27665566071277 2.33140320854194 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.53365503344992e-10 2.27532660331271e-10 2.28406711196761e-10 2.27596219432934e-10 2.31425352232552e-10 2.30088963820115e-10 2.27665566071277e-10 2.33140320854194e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016780119260166967 1.0479548184207053 1.0645402723583786 1.047088013514078 1.0074946629026569 0.9906735327008831 1.026825142912018 0.9480664125437023 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01678011926016697 1.047954818420705 1.064540272358379 1.047088013514078 1.007494662902657 0.9906735327008831 1.026825142912018 0.9480664125437023 ] } "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 ] } }