{ "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" 2.866965785622597 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.866965785622597e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.37158130280102 2.30652880092158 2.29696570424089 2.27769416682701 2.3074323613408 2.26916411699938 2.2848360666105 2.27013012969117 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.37158130280102e-10 2.30652880092158e-10 2.29696570424089e-10 2.27769416682701e-10 2.3074323613408e-10 2.26916411699938e-10 2.2848360666105e-10 2.27013012969117e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ -3.5471589957782554 -3.0006499603423813 -2.4879040623604562 -1.8216534709243801 -2.3239824729346825 -2.0012143999073038 -3.1415138598463774 -2.534990685626154 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ -3.547158995778255 -3.000649960342381 -2.487904062360456 -1.82165347092438 -2.323982472934683 -2.001214399907304 -3.141513859846377 -2.534990685626154 ] } "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 ] } }