{ "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" 3.639085099101067 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.639085099101067e-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" [ 2.54994924450956 2.17683110674893 2.15374581403975 2.19199439319326 2.30387139973762 2.05668233361767 2.12804838595668 2.17172735496206 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.54994924450956e-10 2.17683110674893e-10 2.15374581403975e-10 2.19199439319326e-10 2.30387139973762e-10 2.05668233361767e-10 2.12804838595668e-10 2.17172735496206e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.015303800188143351 1.0103404448517783 1.0179149761870443 1.0223748086239628 0.9831660565747087 0.9715751117157272 0.9817072571554502 1.0013656636383907 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01530380018814335 1.010340444851778 1.017914976187044 1.022374808623963 0.9831660565747087 0.9715751117157272 0.9817072571554502 1.001365663638391 ] } "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 ] } }