{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P6_3mc" } "basis-atom-coordinates" { "source-value" [ [ 0.665435 0.832717 0.581459 ] [ 0.334565 0.167283 0.081459 ] [ 0.832717 0.665435 0.081459 ] [ 0.167283 0.832717 0.581459 ] [ 0.832717 0.167283 0.081459 ] [ 0.167283 0.334565 0.581459 ] [ 0.666667 0.333333 0.754622 ] [ 0.333333 0.666667 0.254622 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Ir" "Ir" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.77763600376 "source-unit" "angstrom" } "c" { "source-value" 6.42282628 "source-unit" "angstrom" } }