{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmmb" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.5 0 ] [ 0 0.75 0.273562 ] [ 0.5 0 0 ] [ 0 0.25 0.726438 ] [ 0 0.25 0.257218 ] [ 0 0.75 0.742782 ] [ 0.5 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0 0.47282 0.865856 ] [ 0.5 0.75 0.635429 ] [ 0.5 0.25 0.605177 ] [ 0 0.022606 0.384709 ] [ 0 0.477394 0.384709 ] [ 0 0.522606 0.615291 ] [ 0.5 0.25 0.123556 ] [ 0.5 0.75 0.394823 ] [ 0 0.97282 0.134144 ] [ 0 0.02718 0.865856 ] [ 0 0.52718 0.134144 ] [ 0.5 0.75 0.876444 ] [ 0 0.977394 0.615291 ] [ 0.5 0.25 0.364571 ] ] } "species" { "source-value" [ "Eu" "Eu" "Eu" "Eu" "Zr" "Zr" "Zr" "Zr" "O" "O" "O" "O" "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" 3.68951742 "source-unit" "angstrom" } "b" { "source-value" 7.50339609 "source-unit" "angstrom" } "c" { "source-value" 10.78081902 "source-unit" "angstrom" } }