{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2" } "basis-atom-coordinates" { "source-value" [ [ 0.825 0.043053 0.473568 ] [ 0.011647 0.749891 0.300121 ] [ 0.988353 0.749891 0.699879 ] [ 0.175 0.043053 0.526432 ] [ 0.325 0.543053 0.473568 ] [ 0.511647 0.249891 0.300121 ] [ 0.488353 0.249891 0.699879 ] [ 0.675 0.543053 0.526432 ] [ 0 0.382676 0.5 ] [ 0.5 0.882676 0.5 ] [ 0.991861 0.199611 0.65681 ] [ 0.008139 0.199611 0.34319 ] [ 0.875194 0.586254 0.48561 ] [ 0.124806 0.586254 0.51439 ] [ 0.491861 0.699611 0.65681 ] [ 0.508139 0.699611 0.34319 ] [ 0.375194 0.086254 0.48561 ] [ 0.624806 0.086254 0.51439 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "C" "C" "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" 9.34650832239 "source-unit" "angstrom" } "b" { "source-value" 4.17083047274 "source-unit" "angstrom" } "c" { "source-value" 7.43516961776 "source-unit" "angstrom" } "beta" { "source-value" 91.4596856431 "source-unit" "degree" } }