{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnb" } "basis-atom-coordinates" { "source-value" [ [ 0.75 0.146514 0.213351 ] [ 0.25 0.853486 0.786649 ] [ 0.75 0.646514 0.286649 ] [ 0.25 0.353486 0.713351 ] [ 0.25 0.325089 0.435294 ] [ 0.75 0.674911 0.564706 ] [ 0.25 0.825089 0.064706 ] [ 0.75 0.174911 0.935294 ] [ 0.25 0.902317 0.398054 ] [ 0.75 0.097683 0.601946 ] [ 0.25 0.402317 0.101946 ] [ 0.75 0.597683 0.898054 ] ] } "species" { "source-value" [ "Re" "Re" "Re" "Re" "Re" "Re" "Re" "Re" "P" "P" "P" "P" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 2.96126202 "source-unit" "angstrom" } "b" { "source-value" 5.57727366 "source-unit" "angstrom" } "c" { "source-value" 10.1288781 "source-unit" "angstrom" } }