{ "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" 3.6131481304764748 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.613148130476475e-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" [ 2.52894919042776 2.26181231572857 2.26899548175348 2.26462358616348 2.31119518123838 2.28825774591773 2.24536485207107 2.39295126654237 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.52894919042776e-10 2.26181231572857e-10 2.26899548175348e-10 2.26462358616348e-10 2.31119518123838e-10 2.28825774591773e-10 2.24536485207107e-10 2.39295126654237e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.016525092403098303 1.4754668272898226 1.4617102212961397 1.4963652380309496 1.42217503789757 1.3354947850587648 1.3714603834970949 1.256286177830125 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.0165250924030983 1.475466827289823 1.46171022129614 1.49636523803095 1.42217503789757 1.335494785058765 1.371460383497095 1.256286177830125 ] } "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 ] } }