{ "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" 3.52000077366829 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.52000077366829e-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" [ 2.46303423235546 2.24078231036183 2.25095399762394 2.2655380346519 2.30908968899936 1.68905888738211 1.64745798410261 1.69260775668218 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46303423235546e-10 2.24078231036183e-10 2.25095399762394e-10 2.2655380346519e-10 2.30908968899936e-10 1.68905888738211e-10 1.64745798410261e-10 1.69260775668218e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.022172641801434242 1.5879467280525483 1.6007927384953977 1.6268996625316496 1.5486379396435266 1.550822518927055 1.57851036427078 1.6069202526154298 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02217264180143424 1.587946728052548 1.600792738495398 1.62689966253165 1.548637939643527 1.550822518927055 1.57851036427078 1.60692025261543 ] } "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 ] } }