{ "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" 3.5199999883770943 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.519999988377094e-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" [ 2.46725181169371 2.22301838085236 2.21325300769915 2.23281780646311 2.2826484351426 2.25033842157209 2.23081407620051 2.20202284236432 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46725181169371e-10 2.22301838085236e-10 2.21325300769915e-10 2.23281780646311e-10 2.2826484351426e-10 2.25033842157209e-10 2.23081407620051e-10 2.20202284236432e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.022170328933562248 1.16528052902675 1.1867879528248062 1.2130228107803454 1.1484573278780046 1.154318839718449 1.1718260110661094 1.2616992581957085 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02217032893356225 1.16528052902675 1.186787952824806 1.213022810780345 1.148457327878005 1.154318839718449 1.171826011066109 1.261699258195708 ] } "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 ] } }