{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmmn" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.5 0.8883 ] [ 0 0 0.1117 ] [ 0 0.5 0.66821 ] [ 0.5 0 0.33179 ] [ 0 0.5 0.036356 ] [ 0.5 0 0.963644 ] ] } "species" { "source-value" [ "In" "In" "Br" "Br" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.68820424 "source-unit" "angstrom" } "b" { "source-value" 4.12550269 "source-unit" "angstrom" } "c" { "source-value" 9.00969134 "source-unit" "angstrom" } }