{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4_2/mnm" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] [ 0.705406 0.705406 0 ] [ 0.294594 0.294594 0 ] [ 0.205406 0.794594 0.5 ] [ 0.794594 0.205406 0.5 ] ] } "species" { "source-value" [ "Pu" "Pu" "Br" "Br" "Br" "Br" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.2389797 "source-unit" "angstrom" } "c" { "source-value" 4.24412268 "source-unit" "angstrom" } }