{ "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 0.841893 0.25 ] [ 0 0.158107 0.75 ] [ 0.5 0.341893 0.25 ] [ 0.5 0.658107 0.75 ] [ 0 0.194318 0.25 ] [ 0 0.805682 0.75 ] [ 0.5 0.694318 0.25 ] [ 0.5 0.305682 0.75 ] ] } "species" { "source-value" [ "Sn" "Sn" "Sn" "Sn" "S" "S" "S" "S" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.80555947663 "source-unit" "angstrom" } "b" { "source-value" 12.1065814373 "source-unit" "angstrom" } "c" { "source-value" 5.79216892 "source-unit" "angstrom" } }