{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pm" } "basis-atom-coordinates" { "source-value" [ [ 0.999626 0.750356 0.998725 ] [ 0.999626 0.249644 0.998725 ] [ 0.50039 0.248869 0.500842 ] [ 0.50039 0.751131 0.500842 ] [ 0.026539 0.5 0.280184 ] [ 0.974278 0 0.72107 ] [ 0.523023 0 0.21886 ] [ 0.477255 0.5 0.779931 ] [ 0.913604 0.5 0.596098 ] [ 0.584227 0.5 0.091135 ] [ 0.4123 0 0.905803 ] [ 0.089713 0 0.407321 ] [ 0.789826 0.5 0.457547 ] [ 0.777154 0.705264 0.666797 ] [ 0.777154 0.294736 0.666797 ] [ 0.767144 0 0.401267 ] [ 0.735152 0 0.901748 ] [ 0.718252 0.70601 0.162006 ] [ 0.718252 0.29399 0.162006 ] [ 0.707819 0.5 0.952053 ] [ 0.292287 0 0.045352 ] [ 0.274417 0.204992 0.834969 ] [ 0.274417 0.795008 0.834969 ] [ 0.262114 0.5 0.094214 ] [ 0.236905 0.5 0.59882 ] [ 0.230975 0.202217 0.337047 ] [ 0.230975 0.797783 0.337047 ] [ 0.206188 0 0.547823 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Mn" "Co" "Co" "Co" "P" "P" "P" "P" "O" "O" "O" "O" "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" 4.75988334 "source-unit" "angstrom" } "b" { "source-value" 6.01533001 "source-unit" "angstrom" } "c" { "source-value" 10.35183155 "source-unit" "angstrom" } "beta" { "source-value" 90.04029465 "source-unit" "degree" } }