{ "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" 3.6150126680731782 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.615012668073178e-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" [ 2.53362991183557 2.19803977259512 2.26393623109147 2.2551565643838 2.26468338900508 2.23144032224067 2.18207008974975 2.37792518313631 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.53362991183557e-10 2.19803977259512e-10 2.26393623109147e-10 2.2551565643838e-10 2.26468338900508e-10 2.23144032224067e-10 2.18207008974975e-10 2.37792518313631e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016771527547116822 1.3598647487054916 1.334092019482513 1.408664400952148 1.299181958430511 1.331379821962588 1.2938954204664628 1.0640916835859866 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01677152754711682 1.359864748705492 1.334092019482513 1.408664400952148 1.299181958430511 1.331379821962588 1.293895420466463 1.064091683585987 ] } "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 ] } }