{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P6/mmm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.5 0 ] [ 0.5 0 0 ] [ 0.5 0.5 0 ] [ 0.786072 0.213928 0 ] [ 0.786072 0.572144 0 ] [ 0.213928 0.786072 0 ] [ 0.572144 0.786072 0 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0.5 ] [ 0 0.5 0.5 ] [ 0.427856 0.213928 0 ] [ 0.213928 0.427856 0 ] ] } "species" { "source-value" [ "W" "W" "W" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.50815614472 "source-unit" "angstrom" } "c" { "source-value" 3.86255331 "source-unit" "angstrom" } }