{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "I4/mmm" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.5 0.135847 ] [ 0.5 0.5 0.864153 ] [ 0 0 0.635847 ] [ 0 0 0.364153 ] [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "species" { "source-value" [ "Bi" "Bi" "Bi" "Bi" "Pd" "Pd" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.43012962838 "source-unit" "angstrom" } "c" { "source-value" 12.9941900013 "source-unit" "angstrom" } }