{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pbnm" } "basis-atom-coordinates" { "source-value" [ [ 0.019064 0.917589 0.75 ] [ 0.519064 0.582411 0.25 ] [ 0.480936 0.417589 0.75 ] [ 0.980936 0.082411 0.25 ] [ 0.5 0 0.5 ] [ 0 0.5 0.5 ] [ 0 0.5 0 ] [ 0.5 0 0 ] [ 0.700886 0.325494 0.443366 ] [ 0.200886 0.174506 0.556634 ] [ 0.799114 0.825494 0.056634 ] [ 0.299114 0.674506 0.943366 ] [ 0.299114 0.674506 0.556634 ] [ 0.799114 0.825494 0.443366 ] [ 0.200886 0.174506 0.943366 ] [ 0.700886 0.325494 0.056634 ] [ 0.118993 0.458152 0.25 ] [ 0.618993 0.041848 0.75 ] [ 0.881007 0.541848 0.75 ] [ 0.381007 0.958152 0.25 ] ] } "species" { "source-value" [ "Dy" "Dy" "Dy" "Dy" "Mn" "Mn" "Mn" "Mn" "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" 5.32774934 "source-unit" "angstrom" } "b" { "source-value" 5.86604428 "source-unit" "angstrom" } "c" { "source-value" 7.49206563 "source-unit" "angstrom" } }