{ "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 0.833734 0 ] [ 0 0.166266 0 ] [ 0.5 0.333734 0 ] [ 0.5 0.666266 0 ] [ 0.212461 0 0.232055 ] [ 0.787539 0 0.767945 ] [ 0.24824 0.819402 0.768011 ] [ 0.75176 0.819402 0.231989 ] [ 0.75176 0.180598 0.231989 ] [ 0.24824 0.180598 0.768011 ] [ 0.712461 0.5 0.232055 ] [ 0.287539 0.5 0.767945 ] [ 0.74824 0.319402 0.768011 ] [ 0.25176 0.319402 0.231989 ] [ 0.25176 0.680598 0.231989 ] [ 0.74824 0.680598 0.768011 ] ] } "species" { "source-value" [ "Gd" "Gd" "Gd" "Gd" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.338920406 "source-unit" "angstrom" } "b" { "source-value" 12.6843995285 "source-unit" "angstrom" } "c" { "source-value" 7.29829100106 "source-unit" "angstrom" } "beta" { "source-value" 107.976841048 "source-unit" "degree" } }