{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Imcm" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0 0.302384 ] [ 0.75 0 0.697616 ] [ 0.75 0.5 0.802384 ] [ 0.25 0.5 0.197616 ] [ 0.25 0.811478 0.914671 ] [ 0.75 0.188522 0.085329 ] [ 0.75 0.811478 0.085329 ] [ 0.25 0.188522 0.914671 ] [ 0.75 0.311478 0.414671 ] [ 0.25 0.688522 0.585329 ] [ 0.25 0.311478 0.585329 ] [ 0.75 0.688522 0.414671 ] ] } "species" { "source-value" [ "Rb" "Rb" "Rb" "Rb" "Hg" "Hg" "Hg" "Hg" "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" 5.40730101 "source-unit" "angstrom" } "b" { "source-value" 8.64809758 "source-unit" "angstrom" } "c" { "source-value" 9.75928208 "source-unit" "angstrom" } }