{ "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" [ [ 0.241901 0.478816 0.12121 ] [ 0.264447 0.490264 0.62171 ] [ 0.758099 0.521184 0.87879 ] [ 0.735553 0.509736 0.37829 ] [ 0.030313 0.993668 0.746521 ] [ 0.969687 0.006332 0.253479 ] [ 0.5 0 0.5 ] [ 0.5 0 1 ] [ 0.063367 0.254222 0.810546 ] [ 0.191769 0.02265 0.059467 ] [ 0.008451 0.268046 0.319613 ] [ 0.191848 0.021102 0.453445 ] [ 0.554947 0.263841 0.583198 ] [ 0.445053 0.736159 0.416802 ] [ 0.365381 0.980598 0.74511 ] [ 0.555131 0.263649 0.048327 ] [ 0.444869 0.736351 0.951673 ] [ 0.808231 0.97735 0.940533 ] [ 0.634619 0.019402 0.25489 ] [ 0.936633 0.745778 0.189454 ] [ 0.808152 0.978898 0.546555 ] [ 0.991549 0.731954 0.680387 ] ] } "species" { "source-value" [ "Rb" "Rb" "Rb" "Rb" "U" "U" "U" "U" "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" 6.97956378 "source-unit" "angstrom" } "b" { "source-value" 7.53415601 "source-unit" "angstrom" } "c" { "source-value" 8.06156401 "source-unit" "angstrom" } "alpha" { "source-value" 105.45132026 "source-unit" "degree" } "beta" { "source-value" 89.82691766 "source-unit" "degree" } "gamma" { "source-value" 98.7778118 "source-unit" "degree" } }