{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.240484 0.761527 0.985113 ] [ 0.759516 0.238473 0.014887 ] [ 0.056468 0.757658 0.402471 ] [ 0.943532 0.242342 0.597529 ] [ 0.479105 0.739893 0.557259 ] [ 0.520895 0.260107 0.442741 ] [ 0.612828 0.723505 0.183722 ] [ 0.387172 0.276495 0.816278 ] [ 0.84173 0.719799 0.762181 ] [ 0.15827 0.280201 0.237819 ] [ 0.295277 0.037714 0.362269 ] [ 0.156744 0.543246 0.645861 ] [ 0.843256 0.456754 0.354139 ] [ 0.704723 0.962286 0.637731 ] [ 0.640183 0.515586 0.814301 ] [ 0.150267 0.15633 0.054754 ] [ 0.359817 0.484414 0.185699 ] [ 0.849733 0.84367 0.945246 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Mo" "Mo" "N" "N" "N" "N" "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" 5.91738419928 "source-unit" "angstrom" } "b" { "source-value" 5.95144141023 "source-unit" "angstrom" } "c" { "source-value" 8.98467031257 "source-unit" "angstrom" } "alpha" { "source-value" 82.8130883228 "source-unit" "degree" } "beta" { "source-value" 71.5161129054 "source-unit" "degree" } "gamma" { "source-value" 68.882087537 "source-unit" "degree" } }