{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_12_12_1" } "basis-atom-coordinates" { "source-value" [ [ 0.22152 0.292801 0.127686 ] [ 0.72152 0.207199 0.872314 ] [ 0.77848 0.792801 0.372314 ] [ 0.27848 0.707199 0.627686 ] [ 0.507056 0.705697 0.873584 ] [ 0.492944 0.205697 0.626416 ] [ 0.007056 0.794303 0.126416 ] [ 0.992944 0.294303 0.373584 ] [ 0.770855 0.512318 0.527084 ] [ 0.270855 0.987682 0.472916 ] [ 0.229145 0.012318 0.972916 ] [ 0.729145 0.487682 0.027084 ] [ 0.777179 0.91144 0.726064 ] [ 0.722821 0.08856 0.226064 ] [ 0.222821 0.41144 0.773936 ] [ 0.277179 0.58856 0.273936 ] ] } "species" { "source-value" [ "Er" "Er" "Er" "Er" "Ag" "Ag" "Ag" "Ag" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.24621119 "source-unit" "angstrom" } "b" { "source-value" 6.82197458 "source-unit" "angstrom" } "c" { "source-value" 13.74417994 "source-unit" "angstrom" } }