{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-62m" } "basis-atom-coordinates" { "source-value" [ [ 0.722158 0.722158 0 ] [ 0 0.277842 0 ] [ 0.613636 0 0.5 ] [ 0.386364 0.386364 0.5 ] [ 0 0.613636 0.5 ] [ 0.333333 0.666667 0 ] [ 0.666667 0.333333 0 ] [ 0.277842 0 0 ] [ 0 0 0.5 ] ] } "species" { "source-value" [ "Lu" "Lu" "Lu" "Lu" "Lu" "Lu" "Lu" "Lu" "Te" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 9.03426768696 "source-unit" "angstrom" } "c" { "source-value" 3.69257572 "source-unit" "angstrom" } }