{ "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" 4.073718130588532 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.073718130588533e-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" [ 1.15806622211652 1.17905311341227 1.24655743662114 1.28172635292148 2.63857149240801 1.16532519603675 1.15578328083118 1.12336028927533 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 1.15806622211652e-10 1.17905311341227e-10 1.24655743662114e-10 1.28172635292148e-10 2.63857149240801e-10 1.16532519603675e-10 1.15578328083118e-10 1.12336028927533e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.011940947808375974 0.4390340960007375 0.4392190301912802 0.4272420909327143 0.39998535077341996 0.39000858348788603 0.4310183140956546 0.45539373154725354 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01194094780837597 0.4390340960007375 0.4392190301912802 0.4272420909327143 0.39998535077342 0.390008583487886 0.4310183140956546 0.4553937315472535 ] } "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 ] } }