{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnb" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.28948 0.3324 ] [ 0.25 0.78948 0.1676 ] [ 0.75 0.71052 0.6676 ] [ 0.75 0.21052 0.8324 ] [ 0.25 0.906135 0.446769 ] [ 0.75 0.093865 0.553231 ] [ 0.75 0.593865 0.946769 ] [ 0.25 0.406135 0.053231 ] [ 0.25 0.346209 0.639005 ] [ 0.75 0.153791 0.139005 ] [ 0.75 0.653791 0.360995 ] [ 0.25 0.846209 0.860995 ] [ 0.25 0.009505 0.669116 ] [ 0.25 0.593405 0.484084 ] [ 0.75 0.490495 0.169116 ] [ 0.75 0.406595 0.515916 ] [ 0.25 0.509505 0.830884 ] [ 0.75 0.906595 0.984084 ] [ 0.25 0.093405 0.015916 ] [ 0.75 0.990495 0.330884 ] ] } "species" { "source-value" [ "Sr" "Sr" "Sr" "Sr" "In" "In" "In" "In" "In" "In" "In" "In" "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" 4.75122402 "source-unit" "angstrom" } "b" { "source-value" 8.69026778 "source-unit" "angstrom" } "c" { "source-value" 12.47522113 "source-unit" "angstrom" } }