{ "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" [ [ 0.896286 0.5 0.582191 ] [ 0.103714 0.5 0.417809 ] [ 0.396286 0 0.582191 ] [ 0.603714 0 0.417809 ] [ 0.147391 0 0.992559 ] [ 0.852609 0 0.007441 ] [ 0.647391 0.5 0.992559 ] [ 0.352609 0.5 0.007441 ] [ 0.800903 0 0.742089 ] [ 0.808823 0.5 0.003545 ] [ 0.088891 0 0.727404 ] [ 0 0 0 ] [ 0.191177 0.5 0.996455 ] [ 0.911109 0 0.272596 ] [ 0.199097 0 0.257911 ] [ 0.300903 0.5 0.742089 ] [ 0.308823 0 0.003545 ] [ 0.588891 0.5 0.727404 ] [ 0.5 0.5 0 ] [ 0.691177 0 0.996455 ] [ 0.411109 0.5 0.272596 ] [ 0.699097 0.5 0.257911 ] ] } "species" { "source-value" [ "Cs" "Cs" "Cs" "Cs" "U" "U" "U" "U" "O" "O" "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" 14.6189358146 "source-unit" "angstrom" } "b" { "source-value" 4.35941544509 "source-unit" "angstrom" } "c" { "source-value" 7.71132556931 "source-unit" "angstrom" } "beta" { "source-value" 113.265110845 "source-unit" "degree" } }