{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmcm" } "basis-atom-coordinates" { "source-value" [ [ 0.145258 0.826381 0.75 ] [ 0.854742 0.173619 0.25 ] [ 0.854742 0.826381 0.25 ] [ 0.145258 0.173619 0.75 ] [ 0.645258 0.326381 0.75 ] [ 0.354742 0.673619 0.25 ] [ 0.354742 0.326381 0.25 ] [ 0.645258 0.673619 0.75 ] [ 0.252983 0 0.25 ] [ 0.747017 0 0.75 ] [ 0.752983 0.5 0.25 ] [ 0.247017 0.5 0.75 ] [ 0.5 0 0.5 ] [ 0.5 0 0 ] [ 0 0.5 0.5 ] [ 0 0.5 0 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "K" "K" "K" "K" "P" "P" "P" "P" "Au" "Au" "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" 7.41316585 "source-unit" "angstrom" } "b" { "source-value" 9.89944912 "source-unit" "angstrom" } "c" { "source-value" 6.35637943 "source-unit" "angstrom" } }