{ "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" 2.8665045946836467 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.866504594683647e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.47999153010251 2.24675702378663 2.21380560590965 2.26445832289084 2.24278731195901 2.23874443937832 2.24749511373614 2.24655702635232 2.30280458576443 2.24013708706864 2.24889359284244 2.28095248714574 2.27492651246296 2.22490305827456 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.47999153010251e-10 2.24675702378663e-10 2.21380560590965e-10 2.26445832289084e-10 2.24278731195901e-10 2.23874443937832e-10 2.24749511373614e-10 2.24655702635232e-10 2.30280458576443e-10 2.24013708706864e-10 2.24889359284244e-10 2.28095248714574e-10 2.27492651246296e-10 2.22490305827456e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.04817526049230718 1.563166565286435 1.669590225736517 1.600664576626508 1.583746121597176 1.3810079050263713 1.517546145342416 1.5489133370564991 1.5020666658559654 1.7456097100906245 1.7154922833234287 1.4496727718900102 1.6801179076765642 1.6323480300837374 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.04817526049230718 1.563166565286435 1.669590225736517 1.600664576626508 1.583746121597176 1.381007905026371 1.517546145342416 1.548913337056499 1.502066665855965 1.745609710090624 1.715492283323429 1.44967277189001 1.680117907676564 1.632348030083737 ] } "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 ] } }