{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2mm" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0.859411 ] [ 0 0.5 0.359411 ] [ 0.5 0 0.503468 ] [ 0.5 0.5 0.003468 ] [ 0.5 0 0.074308 ] [ 0.5 0.258332 0.791806 ] [ 0.5 0.741668 0.791806 ] [ 0.5 0.5 0.574308 ] [ 0.5 0.758332 0.291806 ] [ 0.5 0.241668 0.291806 ] ] } "species" { "source-value" [ "Ca" "Ca" "Sn" "Sn" "S" "S" "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" 4.10337005 "source-unit" "angstrom" } "b" { "source-value" 7.29613448 "source-unit" "angstrom" } "c" { "source-value" 8.69672054 "source-unit" "angstrom" } }