{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmcm" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.196675 0.58016 ] [ 0.5 0.803325 0.41984 ] [ 0.5 0.196675 0.91984 ] [ 0.5 0.803325 0.08016 ] [ 0 0.5 0.5 ] [ 0 0.5 0 ] [ 0 0.264976 0.25 ] [ 0 0.735024 0.75 ] ] } "species" { "source-value" [ "Te" "Te" "Te" "Te" "Au" "Au" "I" "I" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.14020047 "source-unit" "angstrom" } "b" { "source-value" 4.82563827 "source-unit" "angstrom" } "c" { "source-value" 12.97854945 "source-unit" "angstrom" } }