{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.839639 0.120558 0.132343 ] [ 0.160361 0.620558 0.367657 ] [ 0.160361 0.879442 0.867657 ] [ 0.839639 0.379442 0.632343 ] [ 0.666116 0.622614 0.811864 ] [ 0.333884 0.122614 0.688136 ] [ 0.333884 0.377386 0.188136 ] [ 0.666116 0.877386 0.311864 ] [ 0.728295 0.501283 0.209972 ] [ 0.271705 0.001283 0.290028 ] [ 0.271705 0.498717 0.790028 ] [ 0.728295 0.998717 0.709972 ] ] } "species" { "source-value" [ "P" "P" "P" "P" "P" "P" "P" "P" "Rh" "Rh" "Rh" "Rh" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.79158611183 "source-unit" "angstrom" } "b" { "source-value" 5.84430745 "source-unit" "angstrom" } "c" { "source-value" 5.89129102223 "source-unit" "angstrom" } "beta" { "source-value" 112.386018782 "source-unit" "degree" } }