{ "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" 4.044650822877884 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.044650822877884e-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" [ 2.83321140883276 2.53521408119001 2.54763393663305 2.54505850682511 2.62449136002676 2.51503685562211 2.52931720186051 2.66159899178324 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.83321140883276e-10 2.53521408119001e-10 2.54763393663305e-10 2.54505850682511e-10 2.62449136002676e-10 2.51503685562211e-10 2.52931720186051e-10 2.66159899178324e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.012708519103532327 0.6169096362761182 0.6213487193895337 0.6289975644988303 0.6217501682705703 0.6268758389483657 0.6313868139670923 0.5225062408212834 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01270851910353233 0.6169096362761182 0.6213487193895337 0.6289975644988303 0.6217501682705703 0.6268758389483657 0.6313868139670923 0.5225062408212834 ] } "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 ] } }