{ "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" 4.078000083565712 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.078000083565712e-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" [ 2.85904591775022 2.59023904682105 2.62570332588983 2.62197373059823 2.61056011485271 2.5729768247328 2.56673245754137 2.64342233829984 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.85904591775022e-10 2.59023904682105e-10 2.62570332588983e-10 2.62197373059823e-10 2.61056011485271e-10 2.5729768247328e-10 2.56673245754137e-10 2.64342233829984e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.014064774949843631 0.7836491423086782 0.7828276973161068 0.7903116026755692 0.7439050693183993 0.7896666359571801 0.7861894159339732 0.7744081849165562 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01406477494984363 0.7836491423086782 0.7828276973161068 0.7903116026755692 0.7439050693183993 0.7896666359571801 0.7861894159339732 0.7744081849165562 ] } "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 ] } }