{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.510206 0.953672 0.248021 ] [ 0.989794 0.453672 0.251979 ] [ 0.489794 0.046328 0.751979 ] [ 0.010206 0.546328 0.748021 ] [ 0 0 0.5 ] [ 0.5 0.5 0 ] [ 0.5 0.5 0.5 ] [ 0 0 0 ] [ 0.680228 0.230338 0.448834 ] [ 0.819772 0.730338 0.051166 ] [ 0.319772 0.769662 0.551166 ] [ 0.180228 0.269662 0.948834 ] [ 0.772751 0.684916 0.459177 ] [ 0.727249 0.184916 0.040823 ] [ 0.227249 0.315084 0.540823 ] [ 0.272751 0.815084 0.959177 ] [ 0.087402 0.031673 0.228074 ] [ 0.412598 0.531673 0.271926 ] [ 0.912598 0.968327 0.771926 ] [ 0.587402 0.468327 0.728074 ] ] } "species" { "source-value" [ "Sr" "Sr" "Sr" "Sr" "Cd" "Cd" "W" "W" "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" 5.80763975213 "source-unit" "angstrom" } "b" { "source-value" 5.95888518 "source-unit" "angstrom" } "c" { "source-value" 8.25613022294 "source-unit" "angstrom" } "beta" { "source-value" 90.0484843376 "source-unit" "degree" } }