{ "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 0.16967 0 ] [ 0 0.83033 0 ] [ 0.5 0.331965 0 ] [ 0.5 0.668035 0 ] [ 0 0 0.5 ] [ 0 0.336113 0.5 ] [ 0 0.663887 0.5 ] [ 0.5 0.166203 0.5 ] [ 0.5 0.5 0.5 ] [ 0.5 0.833797 0.5 ] [ 0.76878 0.183213 0.279877 ] [ 0.764738 0.5 0.287795 ] [ 0.76878 0.816787 0.279877 ] [ 0.250172 0 0.290451 ] [ 0.259855 0.330789 0.289495 ] [ 0.259855 0.669211 0.289495 ] [ 0.749828 0 0.709549 ] [ 0.740145 0.330789 0.710505 ] [ 0.740145 0.669211 0.710505 ] [ 0.23122 0.183213 0.720123 ] [ 0.235262 0.5 0.712205 ] [ 0.23122 0.816787 0.720123 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Mn" "Mn" "Mn" "Cr" "Cr" "Cr" "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" 5.07949311 "source-unit" "angstrom" } "b" { "source-value" 8.94034651 "source-unit" "angstrom" } "c" { "source-value" 5.166475 "source-unit" "angstrom" } "beta" { "source-value" 108.55039756 "source-unit" "degree" } }