{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pm" } "basis-atom-coordinates" { "source-value" [ [ 0.023265 0.233121 0.977041 ] [ 0.023265 0.766879 0.977041 ] [ 0.498306 0.763344 0.518666 ] [ 0.498306 0.236656 0.518666 ] [ 0.997256 0 0.720257 ] [ 0.476501 0 0.196314 ] [ 0.517232 0.5 0.775471 ] [ 0.986027 0.5 0.286245 ] [ 0.083274 0.5 0.592343 ] [ 0.401944 0.5 0.104133 ] [ 0.59185 0 0.904041 ] [ 0.918465 0 0.408932 ] [ 0.217429 0.5 0.453715 ] [ 0.215992 0.292415 0.6584 ] [ 0.215992 0.707585 0.6584 ] [ 0.233745 0 0.412368 ] [ 0.273701 0 0.908896 ] [ 0.263475 0.298888 0.176785 ] [ 0.263475 0.701112 0.176785 ] [ 0.294183 0.5 0.96815 ] [ 0.731026 0 0.038951 ] [ 0.715889 0.792003 0.834584 ] [ 0.715889 0.207997 0.834584 ] [ 0.721372 0.5 0.1202 ] [ 0.76786 0.5 0.576707 ] [ 0.787832 0.792364 0.333151 ] [ 0.787832 0.207636 0.333151 ] [ 0.778615 0 0.536025 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Cu" "Cu" "Cu" "Sn" "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" 4.82272142 "source-unit" "angstrom" } "b" { "source-value" 6.00254318 "source-unit" "angstrom" } "c" { "source-value" 10.66230512 "source-unit" "angstrom" } "beta" { "source-value" 91.92664879 "source-unit" "degree" } }