{ "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" 2.86696694791317 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.86696694791317e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.35014964508624 2.27411348995008 2.28802029573311 2.30937303908461 2.26834323831882 2.30242348093693 2.25792881871824 2.26701632372312 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.35014964508624e-10 2.27411348995008e-10 2.28802029573311e-10 2.30937303908461e-10 2.26834323831882e-10 2.30242348093693e-10 2.25792881871824e-10 2.26701632372312e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ -3.523639053340019 -3.1065608289449047 -2.7281254485823623 -1.8012010225390505 -2.2997910930796737 -2.122524390619843 -3.1823054228944825 -1.7422601949853231 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ -3.523639053340019 -3.106560828944905 -2.728125448582362 -1.80120102253905 -2.299791093079674 -2.122524390619843 -3.182305422894482 -1.742260194985323 ] } "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 ] } }