{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Ccme" } "basis-atom-coordinates" { "source-value" [ [ 0.858772 0 0.881626 ] [ 0.641228 0 0.381626 ] [ 0.358772 0 0.618374 ] [ 0.141228 0 0.118374 ] [ 0.358772 0.5 0.881626 ] [ 0.141228 0.5 0.381626 ] [ 0.858772 0.5 0.618374 ] [ 0.641228 0.5 0.118374 ] ] } "species" { "source-value" [ "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.34069173541 "source-unit" "angstrom" } "b" { "source-value" 7.98846768825 "source-unit" "angstrom" } "c" { "source-value" 8.65944894 "source-unit" "angstrom" } }