{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Ccmm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.84003 0.25 ] [ 0 0.15997 0.75 ] [ 0.5 0.34003 0.25 ] [ 0.5 0.65997 0.75 ] [ 0.5 0.071131 0.25 ] [ 0.5 0.928869 0.75 ] [ 0 0.571131 0.25 ] [ 0 0.428869 0.75 ] ] } "species" { "source-value" [ "Zr" "Zr" "Zr" "Zr" "Al" "Al" "Al" "Al" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.35523441559 "source-unit" "angstrom" } "b" { "source-value" 10.9546700662 "source-unit" "angstrom" } "c" { "source-value" 4.30527271 "source-unit" "angstrom" } }