{ "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" [ [ 0.00994 0.481909 0.290165 ] [ 0.99006 0.518091 0.709835 ] [ 0.979104 0.009214 0.739919 ] [ 0.020896 0.990786 0.260081 ] [ 0.500255 0.491742 0.210233 ] [ 0.499745 0.508258 0.789767 ] [ 0.49609 0.943019 0.807797 ] [ 0.50391 0.056981 0.192203 ] [ 0.773248 0.344861 0.068566 ] [ 0.226752 0.655139 0.931434 ] [ 0.746448 0.817849 0.104764 ] [ 0.253552 0.182151 0.895236 ] [ 0.698337 0.322222 0.59074 ] [ 0.301663 0.677778 0.40926 ] [ 0.718371 0.847862 0.568865 ] [ 0.281629 0.152138 0.431135 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Mo" "Mo" "Mo" "Mo" "S" "S" "S" "S" "S" "S" "S" "S" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.27668200824 "source-unit" "angstrom" } "b" { "source-value" 6.67196689056 "source-unit" "angstrom" } "c" { "source-value" 6.80222771728 "source-unit" "angstrom" } "alpha" { "source-value" 61.0944724594 "source-unit" "degree" } "beta" { "source-value" 89.9016554454 "source-unit" "degree" } "gamma" { "source-value" 89.7984944457 "source-unit" "degree" } }