{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-cubic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_13" } "basis-atom-coordinates" { "source-value" [ [ 0.077999 0.077999 0.077999 ] [ 0.422001 0.922001 0.577999 ] [ 0.577999 0.422001 0.922001 ] [ 0.922001 0.577999 0.422001 ] [ 0.159 0.659 0.841 ] [ 0.341 0.341 0.341 ] [ 0.659 0.841 0.159 ] [ 0.841 0.159 0.659 ] [ 0.151187 0.848813 0.348813 ] [ 0.348813 0.151187 0.848813 ] [ 0.651187 0.651187 0.651187 ] [ 0.848813 0.348813 0.151187 ] ] } "species" { "source-value" [ "Zr" "Zr" "Zr" "Zr" "Se" "Se" "Se" "Se" "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" 5.88738203 "source-unit" "angstrom" } }