{ "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" 3.613315641880036 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.613315641880036e-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" [ 2.53365452948367 2.27713956341261 2.28340417290383 2.29662578332661 2.31425333891294 2.30088972893082 2.27665621596407 2.38654259234476 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.53365452948367e-10 2.27713956341261e-10 2.28340417290383e-10 2.29662578332661e-10 2.31425333891294e-10 2.30088972893082e-10 2.27665621596407e-10 2.38654259234476e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016780118057555853 1.054292167654416 1.0552923040405793 1.0473241075729793 1.0074946421630087 0.9906735152069186 1.026825083753788 0.9234205266598007 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01678011805755585 1.054292167654416 1.055292304040579 1.047324107572979 1.007494642163009 0.9906735152069186 1.026825083753788 0.9234205266598007 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Cu" "Cu" "Cu" "Cu" ] } "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 ] } }