{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-3m1" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0.075687 ] [ 0 0 0.924313 ] [ 0.333333 0.666667 0.262027 ] [ 0.666667 0.333333 0.737973 ] [ 0.333333 0.666667 0.4172 ] [ 0.666667 0.333333 0.5828 ] [ 0 0 0.5 ] [ 0.333333 0.666667 0.150333 ] [ 0.666667 0.333333 0.849667 ] ] } "species" { "source-value" [ "W" "W" "W" "W" "W" "W" "N" "N" "N" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 2.83520554679 "source-unit" "angstrom" } "c" { "source-value" 17.656657 "source-unit" "angstrom" } }