{ "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" 3.5222107768058777 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.522210776805878e-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" [ 2.4718258285744 2.20058739539121 2.22216600562328 2.20973435198296 2.26926558465806 2.25609773654898 2.21029419373804 2.32784736706111 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.4718258285744e-10 2.20058739539121e-10 2.22216600562328e-10 2.20973435198296e-10 2.26926558465806e-10 2.25609773654898e-10 2.21029419373804e-10 2.32784736706111e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.01423922727396905 1.4593763239889477 1.4713462860532762 1.54467390382969 1.5275387406537468 1.5329051291467126 1.5275252130755903 1.3321198861667365 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01423922727396905 1.459376323988948 1.471346286053276 1.54467390382969 1.527538740653747 1.532905129146713 1.52752521307559 1.332119886166736 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Ni" "Ni" "Ni" "Ni" ] } "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 ] } }