{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cm" } "basis-atom-coordinates" { "source-value" [ [ 0.45703 0 0.494234 ] [ 0.95703 0.5 0.494234 ] [ 0.003009 0 0.985698 ] [ 0.256982 0.5 0.262519 ] [ 0.752145 0.5 0.725408 ] [ 0.503009 0.5 0.985698 ] [ 0.756982 0 0.262519 ] [ 0.252145 0 0.725408 ] [ 0.973163 0.5 0.339294 ] [ 0.690865 0.5 0.532069 ] [ 0.083602 0 0.176008 ] [ 0.342743 0.5 0.4528 ] [ 0.946406 0 0.801672 ] [ 0.054252 0.5 0.647751 ] [ 0.824755 0.5 0.971173 ] [ 0.473163 0 0.339294 ] [ 0.190865 0 0.532069 ] [ 0.583602 0.5 0.176008 ] [ 0.842743 0 0.4528 ] [ 0.446406 0.5 0.801672 ] [ 0.554252 0 0.647751 ] [ 0.324755 0 0.971173 ] ] } "species" { "source-value" [ "Nb" "Nb" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "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" 6.92857036929 "source-unit" "angstrom" } "b" { "source-value" 3.78917629002 "source-unit" "angstrom" } "c" { "source-value" 12.886808794 "source-unit" "angstrom" } "beta" { "source-value" 100.500665672 "source-unit" "degree" } }