{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/m" } "basis-atom-coordinates" { "source-value" [ [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0.77183 0.5 0.768513 ] [ 0.22817 0.5 0.231487 ] [ 0.27183 0 0.768513 ] [ 0.72817 0 0.231487 ] ] } "species" { "source-value" [ "Li" "Li" "Mn" "Mn" "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" 5.48839868 "source-unit" "angstrom" } "b" { "source-value" 2.87175447 "source-unit" "angstrom" } "c" { "source-value" 5.39542238 "source-unit" "angstrom" } "beta" { "source-value" 115.41219105 "source-unit" "degree" } }