{ "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" 3.615034341812134 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.615034341812134e-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" [ 2.5340414018769 2.29832642399881 2.2577946753818 2.28901284566175 2.32528827841919 2.34079442314227 2.32982118253803 2.30946144613426 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.5340414018769e-10 2.29832642399881e-10 2.2577946753818e-10 2.28901284566175e-10 2.32528827841919e-10 2.34079442314227e-10 2.32982118253803e-10 2.30946144613426e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016766664870228824 0.8996433272568791 0.9070124525072603 0.9172287368672012 0.8751554365233641 0.8852569702680655 0.8741670076884935 0.7752984816577838 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01676666487022882 0.8996433272568791 0.9070124525072603 0.9172287368672012 0.8751554365233641 0.8852569702680655 0.8741670076884935 0.7752984816577838 ] } "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 ] } }