{ "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" 3.6336620748043056 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.633662074804306e-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" [ 2.54803718771619 2.32869972484877 2.30500565162055 2.34851561138712 2.33854629768729 2.34956945990387 2.27876305771755 2.29779821700849 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.54803718771619e-10 2.32869972484877e-10 2.30500565162055e-10 2.34851561138712e-10 2.33854629768729e-10 2.34956945990387e-10 2.27876305771755e-10 2.29779821700849e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.012036125702085386 0.8914735756261463 0.8895790265544996 0.924110367728194 0.8688701060411267 0.896407344699936 0.855882505952844 0.7700012478061448 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01203612570208539 0.8914735756261463 0.8895790265544996 0.924110367728194 0.8688701060411267 0.896407344699936 0.855882505952844 0.7700012478061448 ] } "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 ] } }