{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/c" } "basis-atom-coordinates" { "source-value" [ [ 0 0.868661 0.75 ] [ 0.5 0.631339 0.25 ] [ 0.5 0.368661 0.75 ] [ 0 0.131339 0.25 ] [ 0 0.599166 0.25 ] [ 0.5 0.900834 0.75 ] [ 0.5 0.099166 0.25 ] [ 0 0.400834 0.75 ] [ 0.692369 0.932481 0.221875 ] [ 0.807631 0.432481 0.278125 ] [ 0.692369 0.067519 0.721875 ] [ 0.807631 0.567519 0.778125 ] [ 0.192369 0.432481 0.221875 ] [ 0.307631 0.932481 0.278125 ] [ 0.192369 0.567519 0.721875 ] [ 0.307631 0.067519 0.778125 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "Bi" "Bi" "Bi" "Bi" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.92937524298 "source-unit" "angstrom" } "b" { "source-value" 8.20855971045 "source-unit" "angstrom" } "c" { "source-value" 6.08178418736 "source-unit" "angstrom" } "beta" { "source-value" 124.978150212 "source-unit" "degree" } }