{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cc" } "basis-atom-coordinates" { "source-value" [ [ 0.958761 0.596499 0.87059 ] [ 0.958761 0.403501 0.37059 ] [ 0.799611 0.064409 0.883452 ] [ 0.799611 0.935591 0.383452 ] [ 0.458761 0.096499 0.87059 ] [ 0.458761 0.903501 0.37059 ] [ 0.299611 0.564409 0.883452 ] [ 0.299611 0.435591 0.383452 ] [ 0.001524 0.910499 0.013288 ] [ 0.001524 0.089501 0.513288 ] [ 0.828331 0.413509 0.985097 ] [ 0.828331 0.586491 0.485097 ] [ 0.161872 0.40999 0.997573 ] [ 0.161872 0.59001 0.497573 ] [ 0.501524 0.410499 0.013288 ] [ 0.501524 0.589501 0.513288 ] [ 0.328331 0.913509 0.985097 ] [ 0.328331 0.086491 0.485097 ] [ 0.661872 0.90999 0.997573 ] [ 0.661872 0.09001 0.497573 ] ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Se" "Se" "Se" "Se" "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" 11.9590788748 "source-unit" "angstrom" } "b" { "source-value" 6.84680495 "source-unit" "angstrom" } "c" { "source-value" 7.43510619105 "source-unit" "angstrom" } "beta" { "source-value" 121.019814493 "source-unit" "degree" } }