{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4_2/mnm" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0.22191 ] [ 0.5 0.5 0.72191 ] [ 0.5 0.5 0.27809 ] [ 0 0 0.77809 ] [ 0.5 0 0.25 ] [ 0.5 0 0.75 ] [ 0 0.5 0.25 ] [ 0 0.5 0.75 ] [ 0.324398 0.324398 0 ] [ 0.175602 0.824398 0.5 ] [ 0.824398 0.175602 0.5 ] [ 0.675602 0.675602 0 ] [ 0.802736 0.197264 0 ] [ 0.302736 0.302736 0.5 ] [ 0.697264 0.697264 0.5 ] [ 0.197264 0.802736 0 ] [ 0.207576 0.207576 0.364662 ] [ 0.292424 0.707576 0.864662 ] [ 0.707576 0.292424 0.864662 ] [ 0.707576 0.292424 0.135338 ] [ 0.292424 0.707576 0.135338 ] [ 0.792424 0.792424 0.364662 ] [ 0.207576 0.207576 0.635338 ] [ 0.792424 0.792424 0.635338 ] [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "K" "K" "K" "K" "K" "K" "K" "K" "Co" "Co" "Co" "Co" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.67242837 "source-unit" "angstrom" } "c" { "source-value" 11.89045266 "source-unit" "angstrom" } }