{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pm" } "basis-atom-coordinates" { "source-value" [ [ 0.913555 0.5 0.713747 ] [ 0.575488 0.5 0.209474 ] [ 0.414427 0 0.787072 ] [ 0.049842 0 0.285149 ] [ 0.894455 0 0.6109 ] [ 0.588968 0 0.088113 ] [ 0.416837 0.5 0.895074 ] [ 0.103444 0.5 0.406279 ] [ 0.815235 0 0.461515 ] [ 0.764883 0.198382 0.680659 ] [ 0.764883 0.801618 0.680659 ] [ 0.809715 0.5 0.367813 ] [ 0.720405 0.5 0.875743 ] [ 0.731742 0.194918 0.162733 ] [ 0.731742 0.805082 0.162733 ] [ 0.651988 0 0.940678 ] [ 0.365458 0.5 0.04506 ] [ 0.276338 0.697965 0.827127 ] [ 0.276338 0.302035 0.827127 ] [ 0.288313 0 0.107584 ] [ 0.198986 0 0.625715 ] [ 0.256552 0.695171 0.34066 ] [ 0.256552 0.304829 0.34066 ] [ 0.133857 0.5 0.557726 ] ] } "species" { "source-value" [ "Mn" "Mn" "Mn" "Sb" "P" "P" "P" "P" "O" "O" "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" 5.0409713 "source-unit" "angstrom" } "b" { "source-value" 6.15350788 "source-unit" "angstrom" } "c" { "source-value" 10.06642913 "source-unit" "angstrom" } "beta" { "source-value" 91.1426951 "source-unit" "degree" } }