{ "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" [ [ 0.716115 0.890388 0.251147 ] [ 0.283885 0.390388 0.248853 ] [ 0.283885 0.109612 0.748853 ] [ 0.716115 0.609612 0.751147 ] [ 0.378093 0.894264 0.436352 ] [ 0.621907 0.394264 0.063648 ] [ 0.621907 0.105736 0.563648 ] [ 0.378093 0.605736 0.936352 ] [ 0.132593 0.49865 0.734552 ] [ 0.867407 0.99865 0.765448 ] [ 0.867407 0.50135 0.265448 ] [ 0.132593 0.00135 0.234552 ] [ 0.22431 0.699542 0.041382 ] [ 0.77569 0.199542 0.458618 ] [ 0.77569 0.300458 0.958618 ] [ 0.22431 0.800458 0.541382 ] [ 0.60619 0.802089 0.944632 ] [ 0.39381 0.302089 0.555368 ] [ 0.39381 0.197911 0.055368 ] [ 0.60619 0.697911 0.444632 ] ] } "species" { "source-value" [ "Sr" "Sr" "Sr" "Sr" "P" "P" "P" "P" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.1302256 "source-unit" "angstrom" } "b" { "source-value" 7.91294961 "source-unit" "angstrom" } "c" { "source-value" 12.02173742 "source-unit" "angstrom" } "beta" { "source-value" 124.5247065 "source-unit" "degree" } }