{ "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" 3.5200000256299973 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.520000025629997e-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" [ 2.46948863952947 2.16466720863972 2.21773115546961 2.21844792407249 2.23949190420329 2.21367995642165 2.13187171180128 2.32139551976641 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46948863952947e-10 2.16466720863972e-10 2.21773115546961e-10 2.21844792407249e-10 2.23949190420329e-10 2.21367995642165e-10 2.13187171180128e-10 2.32139551976641e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.022103490612942662 1.4098935886848938 1.4167947905740723 1.4497895982459916 1.3639504861831713 1.4022821137229822 1.3825474017886812 1.2526009273650018 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02210349061294266 1.409893588684894 1.416794790574072 1.449789598245992 1.363950486183171 1.402282113722982 1.382547401788681 1.252600927365002 ] } "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 ] } }