{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2" } "basis-atom-coordinates" { "source-value" [ [ 0.885062 0.342645 0.178287 ] [ 0.852667 0.655583 0.636623 ] [ 0.147333 0.655583 0.363377 ] [ 0.114938 0.342645 0.821713 ] [ 0.385062 0.842645 0.178287 ] [ 0.352667 0.155583 0.636623 ] [ 0.647333 0.155583 0.363377 ] [ 0.614938 0.842645 0.821713 ] [ 0 0.998079 0.5 ] [ 0.5 0.498079 0.5 ] [ 0.928461 0.15989 0.560304 ] [ 0.059233 0.839667 0.651584 ] [ 0.071539 0.15989 0.439696 ] [ 0.940767 0.839667 0.348416 ] [ 0.428461 0.65989 0.560304 ] [ 0.559233 0.339667 0.651584 ] [ 0.571539 0.65989 0.439696 ] [ 0.440767 0.339667 0.348416 ] ] } "species" { "source-value" [ "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "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" 13.4070238117 "source-unit" "angstrom" } "b" { "source-value" 5.12243483607 "source-unit" "angstrom" } "c" { "source-value" 7.54928199411 "source-unit" "angstrom" } "beta" { "source-value" 107.772958365 "source-unit" "degree" } }