{ "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" 3.607352703809738 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.607352703809738e-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" [ 2.52513793370529 2.25538530439298 2.26796952629796 2.22337044769389 2.30707104895748 2.28647223802883 2.26900115752016 2.39112413848701 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.52513793370529e-10 2.25538530439298e-10 2.26796952629796e-10 2.22337044769389e-10 2.30707104895748e-10 2.28647223802883e-10 2.26900115752016e-10 2.39112413848701e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.01676879087861151 1.4914089325890492 1.4835019387775445 1.515680351516591 1.4365902751357473 1.3490381003058796 1.38197755226354 1.2664430807228122 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01676879087861151 1.491408932589049 1.483501938777545 1.515680351516591 1.436590275135747 1.34903810030588 1.38197755226354 1.266443080722812 ] } "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 ] } }