{ "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" 3.6110985279083248 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.611098527908325e-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" [ 2.51020223316773 2.2604602862683 2.2397037988089 2.24072346733389 2.29062163562063 2.27620003646123 2.31724079908654 2.31412155985726 2.32713484558535 2.32653709803475 2.31454414157429 2.33975709029637 2.28644289104149 2.32669732666233 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.51020223316773e-10 2.2604602862683e-10 2.2397037988089e-10 2.24072346733389e-10 2.29062163562063e-10 2.27620003646123e-10 2.31724079908654e-10 2.31412155985726e-10 2.32713484558535e-10 2.32653709803475e-10 2.31454414157429e-10 2.33975709029637e-10 2.28644289104149e-10 2.32669732666233e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.018552585710438184 -1.2251496647072375 -0.1279172271105329 0.11459662024383398 0.803528449257808 0.6249228057812022 0.2402907203850207 0.5211078522718031 0.8294290952394335 0.8540708846496511 0.8377563106511839 1.085785529036479 0.9936417697664081 0.9076845365647522 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01855258571043818 -1.225149664707238 -0.1279172271105329 0.114596620243834 0.803528449257808 0.6249228057812022 0.2402907203850207 0.5211078522718031 0.8294290952394335 0.8540708846496511 0.8377563106511839 1.085785529036479 0.9936417697664081 0.9076845365647522 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 3 75 105 165 41 185 33 219 15 293 293 15 437 33 ] } "species" { "source-value" [ "Fe" "Fe" "Fe" "Fe" ] } "tilt-angle" { "source-value" [ 0.0 23.07391806563098 34.04773236999154 38.572650822227786 44.41530859719298 52.20027756457278 62.96430821058772 69.97282751604145 78.46304096718453 88.83061719438597 91.16938280561406 101.5369590328155 110.02717248395858 117.03569178941231 ] "source-unit" "degrees" "si-unit" "radian" "si-value" [ 0.0 0.4027158415806617 0.5942450326942046 0.6732197580699728 0.7751933733103614 0.9110667139567219 1.098934489515255 1.221256227085009 1.369438406004566 1.550386746620723 1.591205906969071 1.772154247585227 1.920336426504785 2.042658164074539 ] } "tilt-axis" { "source-value" [ 1 1 2 ] } }