{ "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" 4.044650807976723 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.044650807976723e-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" [ 2.83320693466181 2.53400080988661 2.54777264722357 2.54351534673401 2.62417616296119 2.51529807121186 2.51990442812275 2.66159653858994 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.83320693466181e-10 2.53400080988661e-10 2.54777264722357e-10 2.54351534673401e-10 2.62417616296119e-10 2.51529807121186e-10 2.51990442812275e-10 2.66159653858994e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.012707191402900416 0.6168830647813864 0.6213470762401975 0.626640492529308 0.6217604597632947 0.6267582828857003 0.6314664829916035 0.522505055670909 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01270719140290042 0.6168830647813864 0.6213470762401975 0.626640492529308 0.6217604597632947 0.6267582828857003 0.6314664829916035 0.522505055670909 ] } "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 ] } }