{ "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" 4.032988503575325 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.032988503575325e-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" [ 2.82329486061505 2.50973727091152 2.53138553592629 2.5111776407499 2.57199604852397 2.55176460638811 2.53110783000271 2.67104475171726 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.82329486061505e-10 2.50973727091152e-10 2.53138553592629e-10 2.5111776407499e-10 2.57199604852397e-10 2.55176460638811e-10 2.53110783000271e-10 2.67104475171726e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.011095171807710432 0.9145318323560345 0.9220110394699729 0.9470500160346926 0.8903160156646125 0.8360057882306828 0.8548893996966799 0.7769077945887632 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01109517180771043 0.9145318323560345 0.9220110394699729 0.9470500160346926 0.8903160156646125 0.8360057882306828 0.8548893996966799 0.7769077945887632 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" ] } "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 ] } }