{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.255709 0.75 0.059747 ] [ 0.752043 0.952241 0.247954 ] [ 0.752043 0.547759 0.247954 ] [ 0.247957 0.452241 0.752046 ] [ 0.247957 0.047759 0.752046 ] [ 0.744291 0.25 0.940253 ] [ 0.267763 0.75 0.405917 ] [ 0.732237 0.25 0.594083 ] [ 0.215255 0.25 0.334737 ] [ 0.784745 0.75 0.665263 ] [ 0.294834 0.25 0.037682 ] [ 0.705166 0.75 0.962318 ] [ 0.637908 0.75 0.108337 ] [ 0.043623 0.25 0.085163 ] [ 0.501256 0.25 0.152654 ] [ 0.144601 0.931367 0.30159 ] [ 0.144601 0.568633 0.30159 ] [ 0.591264 0.75 0.416057 ] [ 0.812148 0.25 0.417888 ] [ 0.187852 0.75 0.582112 ] [ 0.408736 0.25 0.583943 ] [ 0.855399 0.431367 0.69841 ] [ 0.855399 0.068633 0.69841 ] [ 0.498744 0.75 0.847346 ] [ 0.956377 0.75 0.914837 ] [ 0.362092 0.25 0.891663 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Si" "Si" "Bi" "Bi" "B" "B" "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" 5.13550848 "source-unit" "angstrom" } "b" { "source-value" 6.88374069 "source-unit" "angstrom" } "c" { "source-value" 8.8615841 "source-unit" "angstrom" } "beta" { "source-value" 94.22902006 "source-unit" "degree" } }