{ "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" 3.5192944586277033 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.519294458627703e-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" [ 2.46688238003242 2.17623708178309 2.17052627137277 2.1873391010575 2.2374360018663 2.21415344019952 2.20279891509336 2.27833753497266 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.46688238003242e-10 2.17623708178309e-10 2.17052627137277e-10 2.1873391010575e-10 2.2374360018663e-10 2.21415344019952e-10 2.20279891509336e-10 2.27833753497266e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02225552660417615 1.3871267920449377 1.4111867611992182 1.4686558415558209 1.4238543253870144 1.3535590702693954 1.4387050439367657 1.2920383167712888 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02225552660417615 1.387126792044938 1.411186761199218 1.468655841555821 1.423854325387014 1.353559070269395 1.438705043936766 1.292038316771289 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Ni" "Ni" "Ni" "Ni" ] } "tilt-angle" { "source-value" [ 0.0 24.43269767945453 27.79577249602797 32.20422750397202 38.21321070173819 46.82644889274107 52.659006983369785 59.99999999999999 ] "source-unit" "degrees" "si-unit" "radian" "si-value" [ 0.0 0.4264310196508597 0.4851277481909706 0.562069803005627 0.6669463445036643 0.8172757101951847 0.9190730526904897 1.047197551196598 ] } "tilt-axis" { "source-value" [ 1 1 1 ] } }