{ "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" 3.6122690513730054 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.612269051373005e-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" [ 2.36699315672293 2.36932433067309 2.20224842551493 2.30883233159387 2.2556294728553 2.30557758523218 2.36257150101413 2.28599770905698 2.2826512444819 2.28497600802192 2.28722346710738 2.31596590636652 2.22672643556049 2.28896156889093 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.36699315672293e-10 2.36932433067309e-10 2.20224842551493e-10 2.30883233159387e-10 2.2556294728553e-10 2.30557758523218e-10 2.36257150101413e-10 2.28599770905698e-10 2.2826512444819e-10 2.28497600802192e-10 2.28722346710738e-10 2.31596590636652e-10 2.22672643556049e-10 2.28896156889093e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.0186207890520859 -4.133389389631609 0.5276730489617035 -0.16980894110002434 0.6129197775427472 -0.29383786590615063 0.27916315958011606 0.6084405720948723 0.8788586561725356 0.9599932643334445 1.0283445652669299 1.0863501110374836 1.0039369587852276 0.4623246063158063 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.0186207890520859 -4.133389389631609 0.5276730489617035 -0.1698089411000243 0.6129197775427472 -0.2938378659061506 0.2791631595801161 0.6084405720948723 0.8788586561725356 0.9599932643334445 1.02834456526693 1.086350111037484 1.003936958785228 0.4623246063158063 ] } "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 ] } }