{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-62m" } "basis-atom-coordinates" { "source-value" [ [ 0.716705 0 0.5 ] [ 0.283295 0.283295 0.5 ] [ 0 0.716705 0.5 ] [ 0.666667 0.333333 0.5 ] [ 0.333333 0.666667 0.5 ] [ 0.323946 0 0 ] [ 0 0.323946 0 ] [ 0.676054 0.676054 0 ] [ 0.175901 0 0.5 ] [ 0.238987 0.444014 0 ] [ 0.555986 0.794973 0 ] [ 0 0.175901 0.5 ] [ 0.824099 0.824099 0.5 ] [ 0 0.468297 0.5 ] [ 0.468297 0 0.5 ] [ 0.531703 0.531703 0.5 ] [ 0.761013 0.205027 0 ] [ 0.444014 0.238987 0 ] [ 0.794973 0.555986 0 ] [ 0.205027 0.761013 0 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "K" "Dy" "Dy" "Dy" "I" "I" "I" "I" "I" "I" "I" "I" "I" "I" "I" "I" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 14.8697912599 "source-unit" "angstrom" } "c" { "source-value" 4.44776216 "source-unit" "angstrom" } }