{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmcm" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.863259 0.75 ] [ 0.5 0.136741 0.25 ] [ 0 0.363259 0.75 ] [ 0 0.636741 0.25 ] [ 0 0.076826 0.75 ] [ 0 0.923174 0.25 ] [ 0.5 0.576826 0.75 ] [ 0.5 0.423174 0.25 ] ] } "species" { "source-value" [ "Ca" "Ca" "Ca" "Ca" "Ge" "Ge" "Ge" "Ge" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.58838344215 "source-unit" "angstrom" } "b" { "source-value" 10.8865427943 "source-unit" "angstrom" } "c" { "source-value" 4.02001848 "source-unit" "angstrom" } }