{ "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" 3.52422046661377 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.52422046661377e-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" [ 2.46211957099446 2.16585115441304 2.05302170774353 2.19710753445023 2.20736818449366 2.14973026643409 2.35085437474487 2.10828813793716 2.18904055171599 2.15385186563092 2.17700052706125 2.24305430455383 2.14973643457981 2.12829786463741 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46211957099446e-10 2.16585115441304e-10 2.05302170774353e-10 2.19710753445023e-10 2.20736818449366e-10 2.14973026643409e-10 2.35085437474487e-10 2.10828813793716e-10 2.18904055171599e-10 2.15385186563092e-10 2.17700052706125e-10 2.24305430455383e-10 2.14973643457981e-10 2.12829786463741e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.020472359076145398 1.0938343787344376 1.1189438882398108 1.1411818854665452 1.1040058642074864 1.0375078104919702 0.42036228499241113 0.9677946151387156 1.1700063699729875 1.256445940112444 1.2164913585699129 1.164027732056813 1.2382914667165137 1.208537914558881 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.0204723590761454 1.093834378734438 1.118943888239811 1.141181885466545 1.104005864207486 1.03750781049197 0.4203622849924111 0.9677946151387156 1.170006369972987 1.256445940112444 1.216491358569913 1.164027732056813 1.238291466716514 1.208537914558881 ] } "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" [ "Ni" "Ni" "Ni" "Ni" ] } "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 ] } }