{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pc" } "basis-atom-coordinates" { "source-value" [ [ 0.545653 0.743339 0.498038 ] [ 0.545653 0.256661 0.998038 ] [ 0.757427 0.279922 0.284564 ] [ 0.757427 0.720078 0.784564 ] [ 0.240261 0.775148 0.220421 ] [ 0.240261 0.224852 0.720421 ] [ 0.254732 0.335852 0.40035 ] [ 0.254732 0.664148 0.90035 ] [ 0.738459 0.806709 0.09467 ] [ 0.738459 0.193291 0.59467 ] [ 0.058996 0.459032 0.320368 ] [ 0.058996 0.540968 0.820368 ] [ 0.245526 0.571065 0.042946 ] [ 0.245526 0.428935 0.542946 ] [ 0.268776 0.018297 0.390817 ] [ 0.268776 0.981703 0.890817 ] [ 0.453972 0.492063 0.33661 ] [ 0.453972 0.507937 0.83661 ] [ 0.528126 0.951188 0.165598 ] [ 0.528126 0.048812 0.665598 ] [ 0.724836 0.496656 0.107816 ] [ 0.724836 0.503344 0.607816 ] [ 0.742047 0.073579 0.46044 ] [ 0.742047 0.926421 0.96044 ] [ 0.941189 0.925638 0.177363 ] [ 0.941189 0.074362 0.677363 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Nb" "Nb" "P" "P" "P" "P" "O" "O" "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" 6.04106435 "source-unit" "angstrom" } "b" { "source-value" 4.84817265 "source-unit" "angstrom" } "c" { "source-value" 10.39602057 "source-unit" "angstrom" } "beta" { "source-value" 90.12948756 "source-unit" "degree" } }