{ "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" 2.863848514854908 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.863848514854908e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.47609352477755 2.38288099353577 2.38386565472248 2.23625780731194 2.39302006811066 2.36144902934785 2.40253136702016 2.29837884093447 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.47609352477755e-10 2.38288099353577e-10 2.38386565472248e-10 2.23625780731194e-10 2.39302006811066e-10 2.36144902934785e-10 2.40253136702016e-10 2.29837884093447e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.015770064646615133 0.5648531121088372 0.38509107482933597 0.5605332862049993 0.062161065139858494 0.40856816048449307 -0.48783832382456416 0.2710768602180934 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01577006464661513 0.5648531121088372 0.385091074829336 0.5605332862049993 0.06216106513985849 0.4085681604844931 -0.4878383238245642 0.2710768602180934 ] } "short-name" { "source-value" [ "bcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Fe" "Fe" "Fe" "Fe" ] } "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 ] } }