{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P6_3/mcm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.249979 0.25 ] [ 0.750021 0 0.75 ] [ 0.249979 0.249979 0.75 ] [ 0.750021 0.750021 0.25 ] [ 0 0.750021 0.75 ] [ 0.249979 0 0.25 ] [ 0 0 0.5 ] [ 0 0 0 ] ] } "species" { "source-value" [ "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "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" 8.80784081838 "source-unit" "angstrom" } "c" { "source-value" 7.53125992 "source-unit" "angstrom" } }