{ "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" [ [ 0.309559 0.514782 0.90035 ] [ 0.112484 0.493488 0.302275 ] [ 0.303318 0.995805 0.400491 ] [ 0.696682 0.004195 0.599509 ] [ 0.690441 0.485218 0.09965 ] [ 0.5 0.5 0.5 ] [ 0.5 0 0 ] [ 0.887516 0.506512 0.697725 ] [ 0.098634 0.006863 0.797192 ] [ 0.901366 0.993137 0.202808 ] [ 0.759607 0.786811 0.845606 ] [ 0.240393 0.213189 0.154394 ] [ 0.089151 0.226619 0.599266 ] [ 0.910849 0.773381 0.400734 ] [ 0.567174 0.775708 0.239887 ] [ 0.432826 0.224292 0.760113 ] [ 0.923227 0.192267 0.962097 ] [ 0.076773 0.807733 0.037903 ] [ 0.742874 0.206426 0.312443 ] [ 0.257126 0.793574 0.687557 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Te" "Te" "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" 5.77380965777 "source-unit" "angstrom" } "b" { "source-value" 5.81382561228 "source-unit" "angstrom" } "c" { "source-value" 8.6331010481 "source-unit" "angstrom" } "alpha" { "source-value" 108.670620697 "source-unit" "degree" } "beta" { "source-value" 101.555410325 "source-unit" "degree" } "gamma" { "source-value" 102.562418856 "source-unit" "degree" } }