{ "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" 3.884859305620196 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.884859305620196e-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" [ 0.893382417674545 2.43914814144927 0.89940711779856 2.43385410724238 0.923761171569011 0.935280823112557 2.56847601846318 0.923151969421763 2.49376871245333 0.930978569034548 2.42306215673366 0.928011976718008 0.903576343286819 2.49833217917845 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 8.93382417674545e-11 2.43914814144927e-10 8.9940711779856e-11 2.43385410724238e-10 9.237611715690111e-11 9.35280823112557e-11 2.56847601846318e-10 9.231519694217631e-11 2.49376871245333e-10 9.30978569034548e-11 2.42306215673366e-10 9.28011976718008e-11 9.03576343286819e-11 2.49833217917845e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.014775089905345337 0.5295914522520393 0.6200325626429596 0.6290303233784138 0.6119498455652856 0.563178835246283 0.233404137285329 0.5066492955712164 0.6280841126271683 0.7255920505382112 0.70511297613282 0.7144658042508572 0.693879622731273 0.6566204648803369 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01477508990534534 0.5295914522520393 0.6200325626429596 0.6290303233784138 0.6119498455652856 0.563178835246283 0.233404137285329 0.5066492955712164 0.6280841126271683 0.7255920505382112 0.70511297613282 0.7144658042508572 0.693879622731273 0.6566204648803369 ] } "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" [ "Pd" "Pd" "Pd" "Pd" ] } "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 ] } }