{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.358337 0.330808 0.921212 ] [ 0.932181 0.621964 0.845006 ] [ 0.375044 0.803868 0.807686 ] [ 0.624956 0.303868 0.692314 ] [ 0.067819 0.121964 0.654994 ] [ 0.641663 0.830808 0.578788 ] [ 0.358337 0.169192 0.421212 ] [ 0.932181 0.878036 0.345006 ] [ 0.375044 0.696132 0.307686 ] [ 0.624956 0.196132 0.192314 ] [ 0.067819 0.378036 0.154994 ] [ 0.641663 0.669192 0.078788 ] [ 0.838385 0.088908 0.932919 ] [ 0.161615 0.588908 0.567081 ] [ 0.838385 0.411092 0.432919 ] [ 0.161615 0.911092 0.067081 ] [ 0.746691 0.354799 0.957236 ] [ 0.106281 0.049383 0.903911 ] [ 0.689403 0.940904 0.81085 ] [ 0.310597 0.440904 0.68915 ] [ 0.893719 0.549383 0.596089 ] [ 0.253309 0.854799 0.542764 ] [ 0.746691 0.145201 0.457236 ] [ 0.106281 0.450617 0.403911 ] [ 0.689403 0.559096 0.31085 ] [ 0.310597 0.059096 0.18915 ] [ 0.893719 0.950617 0.096089 ] [ 0.253309 0.645201 0.042764 ] ] } "species" { "source-value" [ "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Ho" "Ho" "Ho" "Ho" "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" 7.99294514 "source-unit" "angstrom" } "b" { "source-value" 7.38657076 "source-unit" "angstrom" } "c" { "source-value" 11.76358553 "source-unit" "angstrom" } "beta" { "source-value" 94.08056019 "source-unit" "degree" } }