{ "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" [ [ 0.788284 0.25 0.300703 ] [ 0.211716 0.75 0.699297 ] [ 0.404647 0.25 0.908091 ] [ 0.595353 0.75 0.091909 ] [ 0.037838 0.75 0.434333 ] [ 0.962162 0.25 0.565667 ] [ 0.942893 0.75 0.173585 ] [ 0.057107 0.25 0.826415 ] [ 0.576875 0.75 0.841985 ] [ 0.423125 0.25 0.158015 ] [ 0.276216 0.25 0.507626 ] [ 0.723784 0.75 0.492374 ] ] } "species" { "source-value" [ "Ta" "Ta" "Ni" "Ni" "Ni" "Ni" "Te" "Te" "Te" "Te" "Te" "Te" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.86020543 "source-unit" "angstrom" } "b" { "source-value" 3.71615748 "source-unit" "angstrom" } "c" { "source-value" 10.53373664 "source-unit" "angstrom" } "beta" { "source-value" 110.31353957 "source-unit" "degree" } }