{ "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" 4.05616620182991 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.05616620182991e-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" [ 2.84146822043517 2.60859315193055 2.60986882072832 2.58170262217007 2.60927190050331 2.61447043883045 2.56387424802539 2.61751816280392 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.84146822043517e-10 2.60859315193055e-10 2.60986882072832e-10 2.58170262217007e-10 2.60927190050331e-10 2.61447043883045e-10 2.56387424802539e-10 2.61751816280392e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.014258209303365278 0.6102076837284645 0.6067747655104591 0.6047116940289248 0.5752790525978447 0.5487510606364064 0.597069704246739 0.6020035410809426 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01425820930336528 0.6102076837284645 0.6067747655104591 0.6047116940289248 0.5752790525978447 0.5487510606364064 0.597069704246739 0.6020035410809426 ] } "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 ] } }