{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-6" } "basis-atom-coordinates" { "source-value" [ [ 0.333333 0.666667 0.5 ] [ 0.666667 0.333333 0 ] [ 0.616093 0.574292 0.5 ] [ 0.958199 0.383907 0.5 ] [ 0.425708 0.041801 0.5 ] [ 0.052619 0.611085 0 ] [ 0.558467 0.947381 0 ] [ 0.388915 0.441533 0 ] [ 0.097112 0.883985 0.5 ] [ 0.786873 0.902888 0.5 ] [ 0.116015 0.213127 0.5 ] [ 0.84696 0.718663 0 ] [ 0.871703 0.15304 0 ] [ 0.281337 0.128297 0 ] [ 0 0 0 ] [ 0.596887 0.71963 0 ] [ 0.122743 0.403113 0 ] [ 0.28037 0.877257 0 ] [ 0.886111 0.591687 0.5 ] [ 0.705576 0.113889 0.5 ] [ 0.408313 0.294424 0.5 ] ] } "species" { "source-value" [ "U" "U" "Ni" "Ni" "Ni" "Ni" "Ni" "Ni" "Ni" "Ni" "Ni" "Ni" "Ni" "Ni" "As" "As" "As" "As" "As" "As" "As" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 9.37988403 "source-unit" "angstrom" } "c" { "source-value" 3.80553501 "source-unit" "angstrom" } }