{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmmb" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.75 0.507269 ] [ 0 0.75 0.991229 ] [ 0.5 0.25 0.492731 ] [ 0 0.25 0.008771 ] [ 0.5 0.496963 0.82162 ] [ 0.5 0.996963 0.17838 ] [ 0.5 0.503037 0.17838 ] [ 0.5 0.003037 0.82162 ] [ 0 0.517037 0.333878 ] [ 0 0.482963 0.666122 ] [ 0 0.982963 0.333878 ] [ 0 0.017037 0.666122 ] ] } "species" { "source-value" [ "Nd" "Nd" "Nd" "Nd" "Sb" "Sb" "Sb" "Sb" "Pd" "Pd" "Pd" "Pd" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.54421782 "source-unit" "angstrom" } "b" { "source-value" 8.07438596 "source-unit" "angstrom" } "c" { "source-value" 8.16529251 "source-unit" "angstrom" } }