{ "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" [ [ 0.5 0.735835 0 ] [ 0 0.764165 0 ] [ 0.5 0 0.5 ] [ 0 0.235835 0 ] [ 0.5 0.264165 0 ] [ 0 0.5 0.5 ] [ 0.752916 0 0.004956 ] [ 0.75 0.75 0.5 ] [ 0.747084 0.5 0.995044 ] [ 0.75 0.25 0.5 ] [ 0.252916 0.5 0.004956 ] [ 0.25 0.25 0.5 ] [ 0.247084 0 0.995044 ] [ 0.25 0.75 0.5 ] [ 0.844874 0 0.745412 ] [ 0.654995 0.760956 0.769921 ] [ 0.845005 0.739044 0.230079 ] [ 0.655126 0.5 0.254588 ] [ 0.83926 0.5 0.723451 ] [ 0.654995 0.239044 0.769921 ] [ 0.845005 0.260956 0.230079 ] [ 0.66074 0 0.276549 ] [ 0.344874 0.5 0.745412 ] [ 0.154995 0.260956 0.769921 ] [ 0.345005 0.239044 0.230079 ] [ 0.155126 0 0.254588 ] [ 0.33926 0 0.723451 ] [ 0.154995 0.739044 0.769921 ] [ 0.345005 0.760956 0.230079 ] [ 0.16074 0.5 0.276549 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "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" 11.32026178 "source-unit" "angstrom" } "b" { "source-value" 5.90208904 "source-unit" "angstrom" } "c" { "source-value" 5.04593583 "source-unit" "angstrom" } "beta" { "source-value" 107.14280019 "source-unit" "degree" } }