{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/m" } "basis-atom-coordinates" { "source-value" [ [ 0.181911 0.5 0.271173 ] [ 0.818089 0.5 0.728827 ] [ 0.681911 0 0.271173 ] [ 0.318089 0 0.728827 ] [ 0 0 0.5 ] [ 0.5 0.5 0.5 ] [ 0.883596 0 0.552517 ] [ 0.116404 0 0.447483 ] [ 0.383596 0.5 0.552517 ] [ 0.616404 0.5 0.447483 ] [ 0.870352 0.5 0.149497 ] [ 0.129648 0.5 0.850503 ] [ 0.370352 0 0.149497 ] [ 0.629648 0 0.850503 ] ] } "species" { "source-value" [ "Eu" "Eu" "Eu" "Eu" "C" "C" "N" "N" "N" "N" "Cl" "Cl" "Cl" "Cl" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 9.67645250588 "source-unit" "angstrom" } "b" { "source-value" 4.22697989 "source-unit" "angstrom" } "c" { "source-value" 7.24251766237 "source-unit" "angstrom" } "beta" { "source-value" 98.2365094589 "source-unit" "degree" } }