{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4/nmm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.5 0.142606 ] [ 0.5 0 0.857394 ] [ 0.5 0 0.400067 ] [ 0 0.5 0.599933 ] [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0.5 0.5 0.715684 ] [ 0 0.5 0.929958 ] [ 0 0 0.284316 ] [ 0.5 0 0.556638 ] [ 0 0.5 0.443362 ] [ 0 0 0.715684 ] [ 0.5 0.5 0.284316 ] [ 0.5 0 0.070042 ] ] } "species" { "source-value" [ "K" "K" "Ce" "Ce" "Cu" "Cu" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.45699852505 "source-unit" "angstrom" } "c" { "source-value" 21.1570231204 "source-unit" "angstrom" } }