{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.254614 0.349363 0.103325 ] [ 0.745386 0.650637 0.896675 ] [ 0.745386 0.849363 0.396675 ] [ 0.254614 0.150637 0.603325 ] [ 0.02965 0.795554 0.71414 ] [ 0.97035 0.295554 0.78586 ] [ 0.02965 0.704446 0.21414 ] [ 0.97035 0.204446 0.28586 ] [ 0.657399 0.289994 0.980784 ] [ 0.342601 0.710006 0.019216 ] [ 0.657399 0.210006 0.480784 ] [ 0.564849 0.036757 0.837809 ] [ 0.564849 0.463243 0.337809 ] [ 0.435151 0.963243 0.162191 ] [ 0.435151 0.536757 0.662191 ] [ 0.342601 0.789994 0.519216 ] [ 0.295713 0.376102 0.270192 ] [ 0.135401 0.6862 0.904826 ] [ 0.346802 0.175943 0.460809 ] [ 0.32508 0.898051 0.041051 ] [ 0.864599 0.3138 0.095174 ] [ 0.864599 0.1862 0.595174 ] [ 0.803706 0.078137 0.795709 ] [ 0.753049 0.12486 0.397344 ] [ 0.803706 0.421863 0.295709 ] [ 0.753049 0.37514 0.897344 ] [ 0.475926 0.361781 0.660189 ] [ 0.704287 0.623898 0.729808 ] [ 0.524074 0.638219 0.339811 ] [ 0.32508 0.601949 0.541051 ] [ 0.246951 0.62486 0.102656 ] [ 0.653198 0.824057 0.539191 ] [ 0.346802 0.324057 0.960809 ] [ 0.196294 0.921863 0.204291 ] [ 0.135401 0.8138 0.404826 ] [ 0.246951 0.87514 0.602656 ] [ 0.67492 0.398051 0.458949 ] [ 0.196294 0.578137 0.704291 ] [ 0.653198 0.675943 0.039191 ] [ 0.295713 0.123898 0.770192 ] [ 0.524074 0.861781 0.839811 ] [ 0.704287 0.876102 0.229808 ] [ 0.67492 0.101949 0.958949 ] [ 0.475926 0.138219 0.160189 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Sb" "Sb" "Sb" "Sb" "P" "P" "P" "P" "P" "P" "P" "P" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "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" 5.13265461 "source-unit" "angstrom" } "b" { "source-value" 8.55102742 "source-unit" "angstrom" } "c" { "source-value" 13.35795867 "source-unit" "angstrom" } "beta" { "source-value" 112.03399384 "source-unit" "degree" } }