{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cm" } "basis-atom-coordinates" { "source-value" [ [ 0.141845 0 0.888915 ] [ 0.095377 0.261106 0.251622 ] [ 0.615569 0 0.699745 ] [ 0.095377 0.738894 0.251622 ] [ 0.641845 0.5 0.888915 ] [ 0.595377 0.761106 0.251622 ] [ 0.115569 0.5 0.699745 ] [ 0.595377 0.238894 0.251622 ] [ 0.95147 0 0.391529 ] [ 0.45147 0.5 0.391529 ] [ 0.160307 0 0.391774 ] [ 0.831618 0 0.154219 ] [ 0.907497 0.11322 0.511933 ] [ 0.907497 0.88678 0.511933 ] [ 0.660307 0.5 0.391774 ] [ 0.331618 0.5 0.154219 ] [ 0.407497 0.61322 0.511933 ] [ 0.407497 0.38678 0.511933 ] ] } "species" { "source-value" [ "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "C" "C" "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" 6.94037685854 "source-unit" "angstrom" } "b" { "source-value" 10.3112000686 "source-unit" "angstrom" } "c" { "source-value" 5.89804529337 "source-unit" "angstrom" } "beta" { "source-value" 104.471445058 "source-unit" "degree" } }