{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Imcb" } "basis-atom-coordinates" { "source-value" [ [ 0 0.161274 0.827754 ] [ 0.5 0.338726 0.672246 ] [ 0.5 0.838726 0.827754 ] [ 0.5 0.161274 0.172246 ] [ 0.5 0.661274 0.327754 ] [ 0 0.838726 0.172246 ] [ 0 0.338726 0.327754 ] [ 0 0.661274 0.672246 ] [ 0.75 0 0.5 ] [ 0.25 0 0.5 ] [ 0.25 0.5 0 ] [ 0.75 0.5 0 ] ] } "species" { "source-value" [ "Mg" "Mg" "Mg" "Mg" "Mg" "Mg" "Mg" "Mg" "Cu" "Cu" "Cu" "Cu" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.23995959 "source-unit" "angstrom" } "b" { "source-value" 6.28512414 "source-unit" "angstrom" } "c" { "source-value" 6.70446261 "source-unit" "angstrom" } }