{ "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" 3.5222107768058777 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.522210776805878e-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" [ 2.46983265734881 2.19960663478911 2.19128251678675 2.22494215759877 2.25463655644321 2.14559089299766 2.12583710420013 0.000513991580875588 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46983265734881e-10 2.19960663478911e-10 2.19128251678675e-10 2.22494215759877e-10 2.25463655644321e-10 2.14559089299766e-10 2.12583710420013e-10 5.13991580875588e-14 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.014177405133770372 1.4698719697039229 1.489892544462649 1.523733827692905 1.5241629027726398 1.5198766079938666 1.5942120193886744 1.5007644325323102 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01417740513377037 1.469871969703923 1.489892544462649 1.523733827692905 1.52416290277264 1.519876607993867 1.594212019388674 1.50076443253231 ] } "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 ] } }