{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmmm" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0.5 0.084319 0.5 ] [ 0.5 0.915681 0.5 ] [ 0 0.584319 0.5 ] [ 0 0.415681 0.5 ] [ 0 0.17387 0.5 ] [ 0.5 0.825744 0 ] [ 0 0.82613 0.5 ] [ 0.5 0.174256 0 ] [ 0.5 0.67387 0.5 ] [ 0 0.325744 0 ] [ 0.5 0.32613 0.5 ] [ 0 0.674256 0 ] ] } "species" { "source-value" [ "Ce" "Ce" "Si" "Si" "Si" "Si" "Au" "Au" "Au" "Au" "Au" "Au" "Au" "Au" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.38226770101 "source-unit" "angstrom" } "b" { "source-value" 13.910933014 "source-unit" "angstrom" } "c" { "source-value" 4.37286733 "source-unit" "angstrom" } }