{ "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" 2.863657325506211 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.863657325506212e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.47917388763017 2.25200852885887 2.24957968680464 2.28153919223739 2.27894718714981 2.23244885691146 2.27298545110736 2.27453933138852 2.31573310485331 2.249916396061 2.26384794732545 2.36332910270874 2.28938847271394 2.29714699916028 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.47917388763017e-10 2.25200852885887e-10 2.24957968680464e-10 2.28153919223739e-10 2.27894718714981e-10 2.23244885691146e-10 2.27298545110736e-10 2.27453933138852e-10 2.31573310485331e-10 2.249916396061e-10 2.26384794732545e-10 2.36332910270874e-10 2.28938847271394e-10 2.29714699916028e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.014917206584739868 1.2011804387496476 1.1809246132615274 1.0812573330641302 1.1882871225128697 1.0765621239115055 1.1299782718610256 1.1228389099414686 1.095497889168366 1.2944371433273694 1.2876243764964066 1.1137890992007162 1.2315999883799558 1.1495850178523082 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01491720658473987 1.201180438749648 1.180924613261527 1.08125733306413 1.18828712251287 1.076562123911506 1.129978271861026 1.122838909941469 1.095497889168366 1.294437143327369 1.287624376496407 1.113789099200716 1.231599988379956 1.149585017852308 ] } "short-name" { "source-value" [ "bcc" ] } "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 ] } }