{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-rhombohedral-crystal-npt" "instance-id" 1 "space-group" { "source-value" "R-3m" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0.904108 ] [ 0.666667 0.333333 0.237442 ] [ 0.333333 0.666667 0.570775 ] [ 0 0 0.095892 ] [ 0.666667 0.333333 0.429225 ] [ 0.333333 0.666667 0.762558 ] [ 0 0 0.630573 ] [ 0.666667 0.333333 0.963906 ] [ 0.333333 0.666667 0.297239 ] [ 0 0 0.369427 ] [ 0.666667 0.333333 0.702761 ] [ 0.333333 0.666667 0.036094 ] ] } "species" { "source-value" [ "Te" "Te" "Te" "Te" "Te" "Te" "Pt" "Pt" "Pt" "Pt" "Pt" "Pt" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.01801768699 "source-unit" "angstrom" } "alpha" { "source-value" 90 "source-unit" "degree" } }