{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/m" } "basis-atom-coordinates" { "source-value" [ [ 0.136113 0 0.049118 ] [ 0.863887 0 0.950882 ] [ 0.636113 0.5 0.049118 ] [ 0.363887 0.5 0.950882 ] [ 0.187841 0.5 0.435352 ] [ 0.057548 0 0.402389 ] [ 0.812159 0.5 0.564648 ] [ 0.09154 0.5 0.642687 ] [ 0.90846 0.5 0.357313 ] [ 0.942452 0 0.597611 ] [ 0.687841 0 0.435352 ] [ 0.557548 0.5 0.402389 ] [ 0.312159 0 0.564648 ] [ 0.59154 0 0.642687 ] [ 0.40846 0 0.357313 ] [ 0.442452 0.5 0.597611 ] [ 0.018678 0.5 0.218637 ] [ 0.802118 0 0.304207 ] [ 0.197882 0 0.695793 ] [ 0.981322 0.5 0.781363 ] [ 0.518678 0 0.218637 ] [ 0.302118 0.5 0.304207 ] [ 0.697882 0.5 0.695793 ] [ 0.481322 0 0.781363 ] ] } "species" { "source-value" [ "Rb" "Rb" "Rb" "Rb" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 16.8401419354 "source-unit" "angstrom" } "b" { "source-value" 4.45969842 "source-unit" "angstrom" } "c" { "source-value" 9.10507532471 "source-unit" "angstrom" } "beta" { "source-value" 113.834145681 "source-unit" "degree" } }