{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cm" } "basis-atom-coordinates" { "source-value" [ [ 0.788059 0.242989 0.9908 ] [ 0.229142 0.267382 0.487804 ] [ 0.788059 0.757011 0.9908 ] [ 0.229142 0.732618 0.487804 ] [ 0.288059 0.742989 0.9908 ] [ 0.729142 0.767382 0.487804 ] [ 0.288059 0.257011 0.9908 ] [ 0.729142 0.232618 0.487804 ] [ 0.005115 0 0.502165 ] [ 0.505115 0.5 0.502165 ] [ 0.184207 0 0.339058 ] [ 0.003007 0.181458 0.686458 ] [ 0.810502 0 0.290225 ] [ 0.003007 0.818542 0.686458 ] [ 0.684207 0.5 0.339058 ] [ 0.503007 0.681458 0.686458 ] [ 0.310502 0.5 0.290225 ] [ 0.503007 0.318542 0.686458 ] ] } "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" 6.24211566876 "source-unit" "angstrom" } "b" { "source-value" 6.40944157985 "source-unit" "angstrom" } "c" { "source-value" 4.53893131553 "source-unit" "angstrom" } "beta" { "source-value" 96.0111404588 "source-unit" "degree" } }