{ "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" [ [ 0.82333 0.25 0.289831 ] [ 0.17667 0.75 0.710169 ] [ 0.58154 0.75 0.523937 ] [ 0.41846 0.25 0.476063 ] [ 0.587586 0.75 0.004572 ] [ 0.412414 0.25 0.995428 ] [ 0.916352 0.75 0.006892 ] [ 0.083648 0.25 0.993108 ] [ 0.689304 0.25 0.779258 ] [ 0.310696 0.75 0.220742 ] ] } "species" { "source-value" [ "Er" "Er" "B" "B" "B" "B" "B" "B" "Mo" "Mo" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.41759696193 "source-unit" "angstrom" } "b" { "source-value" 3.15850159 "source-unit" "angstrom" } "c" { "source-value" 6.81616993709 "source-unit" "angstrom" } "beta" { "source-value" 101.716329779 "source-unit" "degree" } }