{ "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" [ [ 0.5 0.917482 0.25 ] [ 0.5 0.082518 0.75 ] [ 0 0.417482 0.25 ] [ 0 0.582518 0.75 ] [ 0 0.200417 0.25 ] [ 0 0.799583 0.75 ] [ 0.5 0.700417 0.25 ] [ 0.5 0.299583 0.75 ] [ 0 0.776125 0.25 ] [ 0 0.223875 0.75 ] [ 0 0.069059 0.25 ] [ 0 0.930941 0.75 ] [ 0.5 0.276125 0.25 ] [ 0.5 0.723875 0.75 ] [ 0.5 0.569059 0.25 ] [ 0.5 0.430941 0.75 ] ] } "species" { "source-value" [ "Cs" "Cs" "Cs" "Cs" "Ag" "Ag" "Ag" "Ag" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.4445840687 "source-unit" "angstrom" } "b" { "source-value" 19.495737494 "source-unit" "angstrom" } "c" { "source-value" 5.76587336 "source-unit" "angstrom" } }