{ "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" 4.049994595348835 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.049994595348835e-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" [ 2.83604608593365 2.54500866874733 2.55954401492076 2.55519921154615 2.57206175408085 2.53614092654438 2.48851798607367 2.52193663270442 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.83604608593365e-10 2.54500866874733e-10 2.55954401492076e-10 2.55519921154615e-10 2.57206175408085e-10 2.53614092654438e-10 2.48851798607367e-10 2.52193663270442e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.0126452618242581 0.5308795180537356 0.5376136860195972 0.5330224630530025 0.49599334844363424 0.5066328988996452 0.5583359434232423 0.5336307197621929 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.0126452618242581 0.5308795180537356 0.5376136860195972 0.5330224630530025 0.4959933484436342 0.5066328988996452 0.5583359434232423 0.5336307197621929 ] } "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 ] } }