{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmmm" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0 0 ] [ 0 0.5 0 ] [ 0.25 0.25 0.5 ] [ 0 0 0 ] [ 0.25 0.75 0.5 ] [ 0.75 0.75 0.5 ] [ 0.5 0.5 0 ] [ 0.75 0.25 0.5 ] [ 0.794204 0.129157 0 ] [ 0.205796 0.870843 0 ] [ 0.794204 0.870843 0 ] [ 0.205796 0.129157 0 ] [ 0 0.338156 0.5 ] [ 0 0.661844 0.5 ] [ 0.294204 0.629157 0 ] [ 0.705796 0.370843 0 ] [ 0.294204 0.370843 0 ] [ 0.705796 0.629157 0 ] [ 0.5 0.838156 0.5 ] [ 0.5 0.161844 0.5 ] ] } "species" { "source-value" [ "Cd" "Cd" "Pt" "Pt" "Pt" "Pt" "Pt" "Pt" "O" "O" "O" "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" 7.31843733 "source-unit" "angstrom" } "b" { "source-value" 10.31815929 "source-unit" "angstrom" } "c" { "source-value" 3.24145987 "source-unit" "angstrom" } }