{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pbnm" } "basis-atom-coordinates" { "source-value" [ [ 0.01211 0.952657 0.75 ] [ 0.48789 0.452657 0.75 ] [ 0.51211 0.547343 0.25 ] [ 0.98789 0.047343 0.25 ] [ 0 0.5 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0 ] [ 0.5 0 0.5 ] [ 0.113545 0.449254 0.25 ] [ 0.194195 0.197268 0.561222 ] [ 0.194195 0.197268 0.938778 ] [ 0.305805 0.697268 0.561222 ] [ 0.305805 0.697268 0.938778 ] [ 0.386455 0.949254 0.25 ] [ 0.613545 0.050746 0.75 ] [ 0.694195 0.302732 0.061222 ] [ 0.694195 0.302732 0.438778 ] [ 0.805805 0.802732 0.061222 ] [ 0.805805 0.802732 0.438778 ] [ 0.886455 0.550746 0.75 ] ] } "species" { "source-value" [ "Cd" "Cd" "Cd" "Cd" "Sn" "Sn" "Sn" "Sn" "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" 5.55403435 "source-unit" "angstrom" } "b" { "source-value" 5.67787314 "source-unit" "angstrom" } "c" { "source-value" 8.03568794 "source-unit" "angstrom" } }