{ "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" 4.024845376610756 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.024845376610756e-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" [ 2.82056533131616 2.55914578552415 2.5480115443478 2.50436047702819 2.54058938788655 2.57678648486042 2.5148656126541 2.55470399440381 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.82056533131616e-10 2.55914578552415e-10 2.5480115443478e-10 2.50436047702819e-10 2.54058938788655e-10 2.57678648486042e-10 2.5148656126541e-10 2.55470399440381e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.00996578439087913 0.4486458744647579 0.4538442877572105 0.44714381268231196 0.4174457494430509 0.40240516963216044 0.4499286156683693 0.5249333264676789 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.00996578439087913 0.4486458744647579 0.4538442877572105 0.447143812682312 0.4174457494430509 0.4024051696321604 0.4499286156683693 0.5249333264676789 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" ] } "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 ] } }