{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-62c" } "basis-atom-coordinates" { "source-value" [ [ 0.331401 0 0 ] [ 0.331401 0 0.5 ] [ 0 0.331401 0.5 ] [ 0 0.331401 0 ] [ 0.668599 0.668599 0 ] [ 0.668599 0.668599 0.5 ] [ 0.395835 0.331344 0.25 ] [ 0.668656 0.064491 0.25 ] [ 0.935509 0.604165 0.25 ] [ 0.604165 0.935509 0.75 ] [ 0 0 0.25 ] [ 0.666667 0.333333 0.75 ] [ 0.064491 0.668656 0.75 ] [ 0.331344 0.395835 0.75 ] [ 0.333333 0.666667 0.25 ] [ 0 0 0.75 ] ] } "species" { "source-value" [ "Sm" "Sm" "Sm" "Sm" "Sm" "Sm" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.02149711974 "source-unit" "angstrom" } "c" { "source-value" 8.56832024 "source-unit" "angstrom" } }