{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4/mbm" } "basis-atom-coordinates" { "source-value" [ [ 0.326774 0.826774 0.5 ] [ 0.826774 0.673226 0.5 ] [ 0.173226 0.326774 0.5 ] [ 0.673226 0.173226 0.5 ] [ 0.5 0.5 0 ] [ 0 0 0 ] [ 0.119582 0.619582 0 ] [ 0.619582 0.880418 0 ] [ 0.880418 0.380418 0 ] [ 0.380418 0.119582 0 ] ] } "species" { "source-value" [ "La" "La" "La" "La" "Mg" "Mg" "Cu" "Cu" "Cu" "Cu" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.93713344 "source-unit" "angstrom" } "c" { "source-value" 3.91188419 "source-unit" "angstrom" } }