{ "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 0 0 ] [ 0 0.5 0.5 ] [ 0.405644 0.966167 0.26744 ] [ 0.594356 0.466167 0.23256 ] [ 0.594356 0.033833 0.73256 ] [ 0.405644 0.533833 0.76744 ] [ 0.087644 0.289772 0.22928 ] [ 0.912356 0.789772 0.27072 ] [ 0.912356 0.710228 0.77072 ] [ 0.087644 0.210228 0.72928 ] [ 0.390155 0.19173 0.997663 ] [ 0.609845 0.69173 0.502337 ] [ 0.609845 0.80827 0.002337 ] [ 0.390155 0.30827 0.497663 ] [ 0.215939 0.61405 0.043994 ] [ 0.784061 0.11405 0.456006 ] [ 0.784061 0.38595 0.956006 ] [ 0.215939 0.88595 0.543994 ] [ 0.263726 0.618468 0.333514 ] [ 0.736274 0.118468 0.166486 ] [ 0.736274 0.381532 0.666486 ] [ 0.263726 0.881532 0.833514 ] ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Co" "Co" "Co" "Co" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.19893515367 "source-unit" "angstrom" } "b" { "source-value" 6.27843808 "source-unit" "angstrom" } "c" { "source-value" 8.56062349763 "source-unit" "angstrom" } "beta" { "source-value" 94.8806661394 "source-unit" "degree" } }