{ "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 0.750961 0.75 ] [ 0.5 0.916763 0.75 ] [ 0 0.249039 0.25 ] [ 0.5 0.083237 0.25 ] [ 0.5 0.250961 0.75 ] [ 0 0.416763 0.75 ] [ 0.5 0.749039 0.25 ] [ 0 0.583237 0.25 ] [ 0 0.082069 0.75 ] [ 0 0.917931 0.25 ] [ 0.5 0.582069 0.75 ] [ 0.5 0.417931 0.25 ] [ 0.240586 0.080355 0.500429 ] [ 0.240586 0.919645 0.000429 ] [ 0.25 0.25 0 ] [ 0.759414 0.080355 0.999571 ] [ 0.75 0.25 0.5 ] [ 0.759414 0.919645 0.499571 ] [ 0.740586 0.580355 0.500429 ] [ 0.740586 0.419645 0.000429 ] [ 0.75 0.75 0 ] [ 0.259414 0.580355 0.999571 ] [ 0.25 0.75 0.5 ] [ 0.259414 0.419645 0.499571 ] ] } "species" { "source-value" [ "Eu" "Eu" "Eu" "Eu" "Eu" "Eu" "Eu" "Eu" "Ca" "Ca" "Ca" "Ca" "O" "O" "O" "O" "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" 6.13910838 "source-unit" "angstrom" } "b" { "source-value" 10.68555892 "source-unit" "angstrom" } "c" { "source-value" 6.12236509 "source-unit" "angstrom" } "beta" { "source-value" 109.24727574 "source-unit" "degree" } }