{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pnmm" } "basis-atom-coordinates" { "source-value" [ [ 0.548175 0.25 0.25 ] [ 0.451825 0.75 0.75 ] [ 0.823071 0.75 0.9959 ] [ 0.823071 0.75 0.5041 ] [ 0.176929 0.25 0.0041 ] [ 0.176929 0.25 0.4959 ] [ 0.324399 0.75 0.134465 ] [ 0.324399 0.75 0.365535 ] [ 0.031835 0.528405 0.25 ] [ 0.031835 0.971595 0.25 ] [ 0.968165 0.028405 0.75 ] [ 0.968165 0.471595 0.75 ] [ 0.675601 0.25 0.634465 ] [ 0.675601 0.25 0.865535 ] [ 0.678668 0.75 0.25 ] [ 0.321332 0.25 0.75 ] ] } "species" { "source-value" [ "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Au" "Au" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.71240128 "source-unit" "angstrom" } "b" { "source-value" 7.19824082 "source-unit" "angstrom" } "c" { "source-value" 13.55545742 "source-unit" "angstrom" } }