{ "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" 2.850997865200043 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.850997865200043e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.25383604969396 2.25845577277505 2.24982428926994 2.26180580314615 2.28663765386168 2.25102475667824 2.24893414168365 2.27147745755405 2.29587524486442 2.30684080388451 2.26009759120847 2.27447034445123 2.2842187416704 2.30887595697613 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.25383604969396e-10 2.25845577277505e-10 2.24982428926994e-10 2.26180580314615e-10 2.28663765386168e-10 2.25102475667824e-10 2.24893414168365e-10 2.27147745755405e-10 2.29587524486442e-10 2.30684080388451e-10 2.26009759120847e-10 2.27447034445123e-10 2.2842187416704e-10 2.30887595697613e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.015046833210767795 1.3145942261961319 1.3897147531770848 1.321451023932964 1.3276010029848118 1.1901172058522274 1.2682297970775886 1.3007966661041024 1.1927077347557533 1.5053397916174933 1.4989580847154287 1.3076986242464945 1.4322030341471597 1.3587240726608758 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01504683321076779 1.314594226196132 1.389714753177085 1.321451023932964 1.327601002984812 1.190117205852227 1.268229797077589 1.300796666104102 1.192707734755753 1.505339791617493 1.498958084715429 1.307698624246495 1.43220303414716 1.358724072660876 ] } "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 ] } }