{ "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" [ [ 0.452704 0.75 0.64591 ] [ 0.547296 0.25 0.35409 ] [ 0.053072 0.25 0.840947 ] [ 0.946928 0.75 0.159053 ] [ 0.048277 0.75 0.685522 ] [ 0.150642 0.25 0.064803 ] [ 0.29878 0.25 0.517802 ] [ 0.3281 0.75 0.879182 ] [ 0.319383 0.75 0.262755 ] [ 0.680617 0.25 0.737245 ] [ 0.6719 0.25 0.120818 ] [ 0.70122 0.75 0.482198 ] [ 0.849358 0.75 0.935197 ] [ 0.951723 0.25 0.314478 ] ] } "species" { "source-value" [ "Sr" "Sr" "La" "La" "I" "I" "I" "I" "I" "I" "I" "I" "I" "I" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 8.69908565 "source-unit" "angstrom" } "b" { "source-value" 4.61446395 "source-unit" "angstrom" } "c" { "source-value" 15.22021319 "source-unit" "angstrom" } "beta" { "source-value" 92.77647068 "source-unit" "degree" } }