{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1" } "basis-atom-coordinates" { "source-value" [ [ 0.007481 0.524265 0.984168 ] [ 0.496762 0.802584 0.828572 ] [ 0.476234 0.522064 0.510677 ] [ 0.523766 0.022064 0.489323 ] [ 0.503238 0.302584 0.171428 ] [ 0.992519 0.024265 0.015832 ] [ 0.053017 0.24827 0.684033 ] [ 0.946983 0.74827 0.315967 ] [ 0.002571 0.761067 0.673516 ] [ 0.997429 0.261067 0.326484 ] [ 0.500264 0.259513 0.85689 ] [ 0.499736 0.759513 0.14311 ] [ 0.704206 0.275664 0.931428 ] [ 0.292475 0.23473 0.919267 ] [ 0.919743 0.885229 0.79717 ] [ 0.072103 0.559 0.736781 ] [ 0.489361 0.267053 0.717049 ] [ 0.23803 0.8388 0.607236 ] [ 0.785436 0.747162 0.558271 ] [ 0.214564 0.247162 0.441729 ] [ 0.76197 0.3388 0.392764 ] [ 0.510639 0.767053 0.282951 ] [ 0.927897 0.059 0.263219 ] [ 0.080257 0.385229 0.20283 ] [ 0.707525 0.73473 0.080733 ] [ 0.295794 0.775664 0.068572 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Sn" "Sn" "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" 5.4331858 "source-unit" "angstrom" } "b" { "source-value" 7.05115003 "source-unit" "angstrom" } "c" { "source-value" 9.39793998 "source-unit" "angstrom" } "beta" { "source-value" 92.92505112 "source-unit" "degree" } }