{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Immm" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.5 0.894258 ] [ 0.5 0.5 0.105742 ] [ 0 0 0.394258 ] [ 0 0 0.605742 ] [ 0 0 0 ] [ 0.5 0.5 0.5 ] [ 0 0 0.821796 ] [ 0 0 0.178204 ] [ 0.5 0.5 0.321796 ] [ 0.5 0.5 0.678204 ] [ 0.5 0 0 ] [ 0 0.5 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] ] } "species" { "source-value" [ "Sr" "Sr" "Sr" "Sr" "Co" "Co" "Cl" "Cl" "Cl" "Cl" "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" 4.01505833332 "source-unit" "angstrom" } "b" { "source-value" 4.26154064186 "source-unit" "angstrom" } "c" { "source-value" 15.2611541094 "source-unit" "angstrom" } }