{ "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" 4.032082748413087 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.032082748413087e-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" [ 2.82565782650906 2.56670929311599 2.54168790092804 2.54738949016902 2.61451369703024 2.56378203937081 2.55152202828268 2.64402321153933 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.82565782650906e-10 2.56670929311599e-10 2.54168790092804e-10 2.54738949016902e-10 2.61451369703024e-10 2.56378203937081e-10 2.55152202828268e-10 2.64402321153933e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.012786834666887141 0.5201988482985191 0.5102825442665757 0.5258650827315581 0.5032032171830775 0.492512616197859 0.49549082695419727 0.4638765385668422 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01278683466688714 0.5201988482985191 0.5102825442665757 0.5258650827315581 0.5032032171830775 0.492512616197859 0.4954908269541973 0.4638765385668422 ] } "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 ] } }