{ "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" [ [ 0.333333 0.666667 0 ] [ 0.666667 0.333333 0.5 ] [ 0.666667 0.333333 0 ] [ 0.333333 0.666667 0.5 ] [ 0.242243 0 0.25 ] [ 0.242243 0.242243 0.75 ] [ 0 0.757757 0.75 ] [ 0 0.242243 0.25 ] [ 0.757757 0.757757 0.25 ] [ 0.757757 0 0.75 ] [ 0.606215 0 0.25 ] [ 0.606215 0.606215 0.75 ] [ 0 0.393785 0.75 ] [ 0 0.606215 0.25 ] [ 0.393785 0.393785 0.25 ] [ 0.393785 0 0.75 ] ] } "species" { "source-value" [ "Tb" "Tb" "Tb" "Tb" "Tb" "Tb" "Tb" "Tb" "Tb" "Tb" "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" 8.56038191118 "source-unit" "angstrom" } "c" { "source-value" 6.46458623 "source-unit" "angstrom" } }