{ "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" 4.0800534188747415 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.080053418874742e-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" [ 2.85699490296373 2.60428276001115 2.58546919570589 2.61055246916953 2.64363998761368 2.62511571293359 2.60891791496641 2.6908967981302 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.85699490296373e-10 2.60428276001115e-10 2.58546919570589e-10 2.61055246916953e-10 2.64363998761368e-10 2.62511571293359e-10 2.60891791496641e-10 2.6908967981302e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.014574858909461873 0.6015255479176734 0.594981847017043 0.5879116986201893 0.5617128953317073 0.5356422883887603 0.5729038281627252 0.5737600284916838 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01457485890946187 0.6015255479176734 0.594981847017043 0.5879116986201893 0.5617128953317073 0.5356422883887603 0.5729038281627252 0.5737600284916838 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Au" "Au" "Au" "Au" ] } "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 ] } }