{ "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" [ [ 0.170923 0 0.575216 ] [ 0.829077 0 0.424784 ] [ 0 0 0 ] [ 0.670923 0.5 0.575216 ] [ 0.329077 0.5 0.424784 ] [ 0.5 0.5 0 ] [ 0.130681 0.5 0.057409 ] [ 0 0.5 0.5 ] [ 0.869319 0.5 0.942591 ] [ 0.630681 0 0.057409 ] [ 0.5 0 0.5 ] [ 0.369319 0 0.942591 ] [ 0.20913 0 0.110019 ] [ 0.79087 0 0.889981 ] [ 0.70913 0.5 0.110019 ] [ 0.29087 0.5 0.889981 ] ] } "species" { "source-value" [ "Ce" "Ce" "Ce" "Ce" "Ce" "Ce" "In" "In" "In" "In" "In" "In" "Ru" "Ru" "Ru" "Ru" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 16.3962162995 "source-unit" "angstrom" } "b" { "source-value" 4.90520212233 "source-unit" "angstrom" } "c" { "source-value" 4.94891989993 "source-unit" "angstrom" } "beta" { "source-value" 98.4478062773 "source-unit" "degree" } }