{ "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" 3.917371600866318 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.917371600866318e-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" [ 2.65859842575818 2.50051673782444 2.52260962706882 2.49947002964573 2.5109709780133 2.48356033394661 2.50176151987201 2.51390193476313 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.65859842575818e-10 2.50051673782444e-10 2.52260962706882e-10 2.49947002964573e-10 2.5109709780133e-10 2.48356033394661e-10 2.50176151987201e-10 2.51390193476313e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.023267448414570128 1.5954502545673221 1.590949659249638 1.6180624944122204 1.5193302091311678 1.5186917400718485 1.6356192088297656 1.6235951062840515 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02326744841457013 1.595450254567322 1.590949659249638 1.61806249441222 1.519330209131168 1.518691740071848 1.635619208829766 1.623595106284051 ] } "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 ] } }