{ "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" 4.949355715513235 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.949355715513235e-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" [ 3.46685547335256 3.1434658003931 3.1716560177647 3.14768586846189 3.21864379377466 3.18077806468861 3.16966290754266 3.28189634454077 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.46685547335256e-10 3.1434658003931e-10 3.1716560177647e-10 3.14768586846189e-10 3.21864379377466e-10 3.18077806468861e-10 3.16966290754266e-10 3.28189634454077e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.005090390184514481 0.21828706770448675 0.21832613729889716 0.2173199367102605 0.20788008332015362 0.199260679070277 0.20964475673402314 0.20557599156490883 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.005090390184514481 0.2182870677044867 0.2183261372988972 0.2173199367102605 0.2078800833201536 0.199260679070277 0.2096447567340231 0.2055759915649088 ] } "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 ] } }