{ "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" [ [ 0.999997 0.248537 0.997914 ] [ 0.999997 0.751463 0.997914 ] [ 0.500903 0.746947 0.499332 ] [ 0.500903 0.253053 0.499332 ] [ 0.028172 0 0.719401 ] [ 0.476155 0 0.219401 ] [ 0.528478 0.5 0.781419 ] [ 0.972167 0.5 0.276904 ] [ 0.090808 0.5 0.594828 ] [ 0.411601 0.5 0.089243 ] [ 0.59016 0 0.907895 ] [ 0.906839 0 0.410913 ] [ 0.214768 0.5 0.459667 ] [ 0.222916 0.300575 0.663256 ] [ 0.222916 0.699425 0.663256 ] [ 0.227513 0 0.402937 ] [ 0.269172 0 0.903577 ] [ 0.282949 0.297797 0.157929 ] [ 0.282949 0.702203 0.157929 ] [ 0.285852 0.5 0.955031 ] [ 0.711298 0 0.043784 ] [ 0.722332 0.800715 0.839477 ] [ 0.722332 0.199285 0.839477 ] [ 0.732743 0.5 0.088492 ] [ 0.770023 0.5 0.598635 ] [ 0.767425 0.803861 0.342548 ] [ 0.767425 0.196139 0.342548 ] [ 0.791206 0 0.546962 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Mn" "Mn" "Mn" "Nb" "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" 4.79034902 "source-unit" "angstrom" } "b" { "source-value" 6.23068074 "source-unit" "angstrom" } "c" { "source-value" 10.66667165 "source-unit" "angstrom" } "beta" { "source-value" 90.01181106 "source-unit" "degree" } }