{ "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" [ [ 0.25 0.950095 0.709412 ] [ 0.75 0.049905 0.290588 ] [ 0.25 0.450095 0.790588 ] [ 0.75 0.549905 0.209412 ] [ 0.75 0.179474 0.943899 ] [ 0.25 0.820526 0.056101 ] [ 0.75 0.679474 0.556101 ] [ 0.25 0.320526 0.443899 ] [ 0.25 0.786055 0.379479 ] [ 0.75 0.213945 0.620521 ] [ 0.25 0.286055 0.120521 ] [ 0.75 0.713945 0.879479 ] ] } "species" { "source-value" [ "Mg" "Mg" "Mg" "Mg" "Mg" "Mg" "Mg" "Mg" "Hg" "Hg" "Hg" "Hg" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.68969949 "source-unit" "angstrom" } "b" { "source-value" 6.17943003 "source-unit" "angstrom" } "c" { "source-value" 8.97172484 "source-unit" "angstrom" } }