{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2/m" } "basis-atom-coordinates" { "source-value" [ [ 0 0.749216 0 ] [ 0 0.250784 0 ] [ 0.5 0.5 0 ] [ 0.5 0 0 ] [ 0 0.5 0.5 ] [ 0 0 0.5 ] [ 0.5 0.750052 0.5 ] [ 0.5 0.249948 0.5 ] [ 0.758204 0.748884 0.272523 ] [ 0.758204 0.251116 0.272523 ] [ 0.744541 0.5 0.72665 ] [ 0.255459 0.5 0.27335 ] [ 0.741834 0 0.729399 ] [ 0.241796 0.748884 0.727477 ] [ 0.258166 0 0.270601 ] [ 0.241796 0.251116 0.727477 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Cr" "Fe" "Fe" "Fe" "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" 5.16054434 "source-unit" "angstrom" } "b" { "source-value" 5.95163945 "source-unit" "angstrom" } "c" { "source-value" 5.17951989 "source-unit" "angstrom" } "beta" { "source-value" 109.46109781 "source-unit" "degree" } }