{ "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" [ [ 0.35819 0.331916 0.92068 ] [ 0.930554 0.621595 0.844746 ] [ 0.375657 0.803843 0.807672 ] [ 0.624343 0.303843 0.692328 ] [ 0.069446 0.121595 0.655254 ] [ 0.64181 0.831916 0.57932 ] [ 0.35819 0.168084 0.42068 ] [ 0.930554 0.878405 0.344746 ] [ 0.375657 0.696157 0.307672 ] [ 0.624343 0.196157 0.192328 ] [ 0.069446 0.378405 0.155254 ] [ 0.64181 0.668084 0.07932 ] [ 0.837822 0.089444 0.932521 ] [ 0.162178 0.589444 0.567479 ] [ 0.837822 0.410556 0.432521 ] [ 0.162178 0.910556 0.067479 ] [ 0.746245 0.356121 0.956508 ] [ 0.107014 0.050755 0.903577 ] [ 0.688625 0.941133 0.810827 ] [ 0.311375 0.441133 0.689173 ] [ 0.892986 0.550755 0.596423 ] [ 0.253755 0.856121 0.543492 ] [ 0.746245 0.143879 0.456508 ] [ 0.107014 0.449245 0.403577 ] [ 0.688625 0.558867 0.310827 ] [ 0.311375 0.058867 0.189173 ] [ 0.892986 0.949245 0.096423 ] [ 0.253755 0.643879 0.043492 ] ] } "species" { "source-value" [ "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Dy" "Dy" "Dy" "Dy" "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" 8.01509896 "source-unit" "angstrom" } "b" { "source-value" 7.3939573 "source-unit" "angstrom" } "c" { "source-value" 11.76353643 "source-unit" "angstrom" } "beta" { "source-value" 94.01732297 "source-unit" "degree" } }