{ "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" [ [ 0.613177 0.162467 0.190683 ] [ 0.839076 0.444527 0.213264 ] [ 0.160924 0.944527 0.286736 ] [ 0.386823 0.662467 0.309317 ] [ 0.613177 0.337533 0.690683 ] [ 0.839076 0.055473 0.713264 ] [ 0.160924 0.555473 0.786736 ] [ 0.386823 0.837533 0.809317 ] [ 0.055787 0.114656 0.060959 ] [ 0.661609 0.304326 0.041028 ] [ 0.673471 0.998219 0.315899 ] [ 0.326529 0.498219 0.184101 ] [ 0.944213 0.614656 0.439041 ] [ 0.338391 0.804326 0.458972 ] [ 0.661609 0.195674 0.541028 ] [ 0.055787 0.385344 0.560959 ] [ 0.673471 0.501781 0.815899 ] [ 0.326529 0.001781 0.684101 ] [ 0.338391 0.695674 0.958972 ] [ 0.944213 0.885344 0.939041 ] ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "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" 3.40005919 "source-unit" "angstrom" } "b" { "source-value" 11.55338107 "source-unit" "angstrom" } "c" { "source-value" 5.20758868 "source-unit" "angstrom" } "beta" { "source-value" 107.62462257 "source-unit" "degree" } }