{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pnmm" } "basis-atom-coordinates" { "source-value" [ [ 0.893683 0.5 0 ] [ 0.106317 0 0.5 ] [ 0.364861 0.5 0.269 ] [ 0.364861 0.5 0.731 ] [ 0.635139 0 0.231 ] [ 0.635139 0 0.769 ] [ 0.786597 0.5 0.5 ] [ 0.213403 0 0 ] [ 0.656004 0.290634 0.5 ] [ 0.343996 0.209366 0 ] [ 0.033645 0.5 0.5 ] [ 0.966355 0 0 ] [ 0.343996 0.790634 0 ] [ 0.656004 0.709366 0.5 ] ] } "species" { "source-value" [ "Rb" "Rb" "Na" "Na" "Na" "Na" "B" "B" "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" 5.63031927 "source-unit" "angstrom" } "b" { "source-value" 5.74036613 "source-unit" "angstrom" } "c" { "source-value" 6.19913601 "source-unit" "angstrom" } }