{ "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" 4.949355721473694 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.949355721473694e-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" [ 3.46685583511278 3.13565142966179 3.15245398437822 3.14876226865341 3.21873662008362 3.15801932337149 3.15226783751044 3.28189313546565 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.46685583511278e-10 3.13565142966179e-10 3.15245398437822e-10 3.14876226865341e-10 3.21873662008362e-10 3.15801932337149e-10 3.15226783751044e-10 3.28189313546565e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.005090923475143357 0.21866641617489202 0.2197701250920149 0.22028605029425713 0.20788021193763775 0.19913841042849334 0.20798978490294123 0.20557614194602292 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.005090923475143357 0.218666416174892 0.2197701250920149 0.2202860502942571 0.2078802119376378 0.1991384104284933 0.2079897849029412 0.2055761419460229 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Pb" "Pb" "Pb" "Pb" ] } "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 ] } }