{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.775192 0.997668 0.218858 ] [ 0.775192 0.502332 0.218858 ] [ 0.224808 0.497668 0.781142 ] [ 0.224808 0.002332 0.781142 ] [ 0.224985 0.25 0.35033 ] [ 0.775015 0.75 0.64967 ] [ 0.286364 0.75 0.420091 ] [ 0.713636 0.25 0.579909 ] [ 0.263075 0.25 0.052225 ] [ 0.736925 0.75 0.947775 ] [ 0.706421 0.75 0.094354 ] [ 0.029909 0.25 0.117877 ] [ 0.468219 0.25 0.15103 ] [ 0.18188 0.939673 0.334446 ] [ 0.18188 0.560327 0.334446 ] [ 0.809029 0.25 0.406899 ] [ 0.596937 0.75 0.427172 ] [ 0.403063 0.25 0.572828 ] [ 0.190971 0.75 0.593101 ] [ 0.81812 0.439673 0.665554 ] [ 0.81812 0.060327 0.665554 ] [ 0.531781 0.75 0.84897 ] [ 0.970091 0.75 0.882123 ] [ 0.293579 0.25 0.905646 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Sc" "Sc" "P" "P" "C" "C" "O" "O" "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" 5.02280047 "source-unit" "angstrom" } "b" { "source-value" 6.57745248 "source-unit" "angstrom" } "c" { "source-value" 8.60386612 "source-unit" "angstrom" } "beta" { "source-value" 90.95235519 "source-unit" "degree" } }