{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.934485 0.75 0.679134 ] [ 0.747056 0.25 0.017587 ] [ 0.065515 0.25 0.320866 ] [ 0.252944 0.75 0.982413 ] [ 0.536048 0.75 0.237639 ] [ 0.298015 0.75 0.713695 ] [ 0.538573 0.75 0.66055 ] [ 0.701985 0.25 0.286305 ] [ 0.463952 0.25 0.762361 ] [ 0.461427 0.25 0.33945 ] [ 0.523873 0.75 0.892788 ] [ 0.082261 0.25 0.078718 ] [ 0.379033 0.25 0.537664 ] [ 0.620967 0.75 0.462336 ] [ 0.917739 0.75 0.921282 ] [ 0.728376 0.25 0.744619 ] [ 0.117744 0.75 0.511072 ] [ 0.174321 0.25 0.789469 ] [ 0.825679 0.75 0.210531 ] [ 0.882256 0.25 0.488928 ] [ 0.476127 0.25 0.107212 ] [ 0.271624 0.75 0.255381 ] ] } "species" { "source-value" [ "Sm" "Sm" "Sm" "Sm" "Mn" "Mn" "Mn" "Mn" "Mn" "Mn" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 10.3165557112 "source-unit" "angstrom" } "b" { "source-value" 4.46192769 "source-unit" "angstrom" } "c" { "source-value" 13.3304452337 "source-unit" "angstrom" } "beta" { "source-value" 106.534130237 "source-unit" "degree" } }