{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmmm" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.217522 0 0.5 ] [ 0 0.312937 0 ] [ 0 0.687063 0 ] [ 0.782478 0 0.5 ] [ 0.717522 0.5 0.5 ] [ 0.5 0.812937 0 ] [ 0.5 0.187063 0 ] [ 0.282478 0.5 0.5 ] ] } "species" { "source-value" [ "Zn" "Zn" "Re" "Re" "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" 6.54986872 "source-unit" "angstrom" } "b" { "source-value" 6.72760668 "source-unit" "angstrom" } "c" { "source-value" 3.1096901 "source-unit" "angstrom" } }