{ "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" 4.070949114859104 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.070949114859104e-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" [ 2.8424598820776 2.49019494930492 2.4702726519305 2.45491989454802 2.50516915568987 2.49387375519267 2.45220411125537 2.47216092023545 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.8424598820776e-10 2.49019494930492e-10 2.4702726519305e-10 2.45491989454802e-10 2.50516915568987e-10 2.49387375519267e-10 2.45220411125537e-10 2.47216092023545e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.012550715454533332 0.6574727703115372 0.6599682121330808 0.6678004301907583 0.6434547336428711 0.6518669984961724 0.6954517096394932 0.6630111795280352 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01255071545453333 0.6574727703115372 0.6599682121330808 0.6678004301907583 0.6434547336428711 0.6518669984961724 0.6954517096394932 0.6630111795280352 ] } "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 ] } }