{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1" } "basis-atom-coordinates" { "source-value" [ [ 0.748804 0.541893 0.220003 ] [ 0.251196 0.041893 0.779997 ] [ 0.219382 0.225932 0.349345 ] [ 0.780618 0.725932 0.650655 ] [ 0.280923 0.733875 0.434172 ] [ 0.719077 0.233875 0.565828 ] [ 0.273976 0.266603 0.082588 ] [ 0.726024 0.766603 0.917412 ] [ 0.693028 0.775861 0.036879 ] [ 0.068738 0.26065 0.140019 ] [ 0.445463 0.259997 0.172555 ] [ 0.229209 0.909424 0.348198 ] [ 0.217611 0.553208 0.356359 ] [ 0.862489 0.246304 0.436776 ] [ 0.541933 0.728404 0.471529 ] [ 0.458067 0.228404 0.528471 ] [ 0.137511 0.746304 0.563224 ] [ 0.782389 0.053208 0.643641 ] [ 0.770791 0.409424 0.651802 ] [ 0.554537 0.759997 0.827445 ] [ 0.931262 0.76065 0.859981 ] [ 0.306972 0.275861 0.963121 ] ] } "species" { "source-value" [ "K" "K" "Ce" "Ce" "P" "P" "C" "C" "O" "O" "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" 5.80879358 "source-unit" "angstrom" } "b" { "source-value" 7.08668889 "source-unit" "angstrom" } "c" { "source-value" 10.14915341 "source-unit" "angstrom" } "beta" { "source-value" 90.48397941 "source-unit" "degree" } }