{ "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 0.400386 0.25 ] [ 0 0.599614 0.75 ] [ 0 0 0 ] [ 0 0 0.5 ] [ 0.5 0.066816 0.25 ] [ 0.5 0.933184 0.75 ] [ 0.5 0.685912 0.064181 ] [ 0.5 0.314088 0.935819 ] [ 0.5 0.685912 0.435819 ] [ 0.5 0.314088 0.564181 ] [ 0 0.806163 0.25 ] [ 0 0.193837 0.75 ] ] } "species" { "source-value" [ "Ca" "Ca" "In" "In" "In" "In" "In" "In" "In" "In" "Rh" "Rh" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.28545716 "source-unit" "angstrom" } "b" { "source-value" 7.58678659 "source-unit" "angstrom" } "c" { "source-value" 8.78004618 "source-unit" "angstrom" } }