{ "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" 4.03330184519291 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.03330184519291e-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" [ 2.8269449325024 2.56351669524745 2.54335032997538 2.52696132065223 2.54167855978858 2.54295783569543 2.48591419249643 2.54899834527782 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.8269449325024e-10 2.56351669524745e-10 2.54335032997538e-10 2.52696132065223e-10 2.54167855978858e-10 2.54295783569543e-10 2.48591419249643e-10 2.54899834527782e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.01278697877515122 0.5567634548738589 0.5666224483554283 0.5806694557626558 0.5540571935790586 0.5324412663620528 0.6029286371118 0.5751342832629366 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01278697877515122 0.5567634548738589 0.5666224483554283 0.5806694557626558 0.5540571935790586 0.5324412663620528 0.6029286371118 0.5751342832629366 ] } "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 ] } }