{ "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" 3.5226424932479863 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.522642493247986e-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" [ 2.46598665297418 2.20657197114418 2.21915085966087 2.21837582812793 2.25600907498431 2.23367411236694 2.21899843926851 2.33685524107902 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46598665297418e-10 2.20657197114418e-10 2.21915085966087e-10 2.21837582812793e-10 2.25600907498431e-10 2.23367411236694e-10 2.21899843926851e-10 2.33685524107902e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02109537709924174 1.9253645848146432 1.9253359918839652 2.001700908306765 1.8631598726286613 1.7493123899666987 1.7799192605464362 1.6485419468226128 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02109537709924174 1.925364584814643 1.925335991883965 2.001700908306765 1.863159872628661 1.749312389966699 1.779919260546436 1.648541946822613 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Ni" "Ni" "Ni" "Ni" ] } "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 ] } }