{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pc" } "basis-atom-coordinates" { "source-value" [ [ 0.514552 0.235126 0.661702 ] [ 0.445008 0.906191 0.628827 ] [ 0.53947 0.428608 0.875817 ] [ 0.514552 0.764874 0.161702 ] [ 0.445008 0.093809 0.128827 ] [ 0.53947 0.571392 0.375817 ] [ 0.987814 0.577872 0.124841 ] [ 0.943567 0.243363 0.117462 ] [ 0.013975 0.052247 0.3773 ] [ 0.987814 0.422128 0.624841 ] [ 0.943567 0.756637 0.617462 ] [ 0.013975 0.947753 0.8773 ] [ 0.446491 0.573659 0.620151 ] [ 0.96139 0.903816 0.126869 ] [ 0.560488 0.066654 0.89335 ] [ 0.019343 0.413036 0.355874 ] [ 0.96139 0.096184 0.626869 ] [ 0.446491 0.426341 0.120151 ] [ 0.019343 0.586964 0.855874 ] [ 0.560488 0.933346 0.39335 ] [ 0.866434 0.571973 0.928915 ] [ 0.332695 0.931305 0.417882 ] [ 0.72947 0.193135 0.92019 ] [ 0.122769 0.535727 0.318569 ] [ 0.062992 0.272481 0.315517 ] [ 0.627324 0.942799 0.840482 ] [ 0.384982 0.435233 0.655949 ] [ 0.303129 0.698714 0.61626 ] [ 0.840681 0.778355 0.137447 ] [ 0.877293 0.036151 0.169181 ] [ 0.166499 0.085082 0.580715 ] [ 0.674311 0.421075 0.087517 ] [ 0.332695 0.068695 0.917882 ] [ 0.866434 0.428027 0.428915 ] [ 0.72947 0.806865 0.42019 ] [ 0.122769 0.464273 0.818569 ] [ 0.062992 0.727519 0.815517 ] [ 0.627324 0.057201 0.340482 ] [ 0.384982 0.564767 0.155949 ] [ 0.840681 0.221645 0.637447 ] [ 0.877293 0.963849 0.669181 ] [ 0.303129 0.301286 0.11626 ] [ 0.674311 0.578925 0.587517 ] [ 0.166499 0.914918 0.080715 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Mn" "Mn" "Mn" "Mn" "Mn" "Mn" "B" "B" "B" "B" "B" "B" "B" "B" "O" "O" "O" "O" "O" "O" "O" "O" "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" 5.3465256 "source-unit" "angstrom" } "b" { "source-value" 9.07771887 "source-unit" "angstrom" } "c" { "source-value" 10.79984048 "source-unit" "angstrom" } "beta" { "source-value" 117.16169294 "source-unit" "degree" } }