{ "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" 3.5878697186708446 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.587869718670845e-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" [ 2.51523649104972 2.27236477054189 2.2732641682793 2.30224810624723 2.32653725534808 2.32230142577829 2.30976196307338 2.28407814687234 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.51523649104972e-10 2.27236477054189e-10 2.2732641682793e-10 2.30224810624723e-10 2.32653725534808e-10 2.32230142577829e-10 2.30976196307338e-10 2.28407814687234e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016933391042662328 0.9299147997314424 0.9435615695671252 0.9535413792712316 0.9070354202902705 0.9013608470193492 0.9074562101366379 0.7106256483062167 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01693339104266233 0.9299147997314424 0.9435615695671252 0.9535413792712316 0.9070354202902705 0.9013608470193492 0.9074562101366379 0.7106256483062167 ] } "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 ] } }