{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P1" } "basis-atom-coordinates" { "source-value" [ [ 0.756727 0.918274 0.119028 ] [ 0.754377 0.918395 0.619963 ] [ 0.000451 0.739512 0.374476 ] [ 0.499956 0.739946 0.37536 ] [ 0.499198 0.740452 0.87355 ] [ 0.496692 0.258625 0.124459 ] [ 0.497125 0.261665 0.622321 ] [ 0.00388 0.260603 0.62607 ] [ 0.983981 0.724429 0.881515 ] [ 0.014585 0.27117 0.123488 ] [ 0.241361 0.093074 0.373507 ] [ 0.236012 0.089102 0.875109 ] [ 0.24962 0.649232 0.107081 ] [ 0.247427 0.648089 0.609845 ] [ 0.752491 0.351646 0.387942 ] [ 0.752401 0.348876 0.891178 ] [ 0.75593 0.583027 0.145881 ] [ 0.753535 0.588318 0.649149 ] [ 0.247241 0.404634 0.349463 ] [ 0.244992 0.410998 0.854183 ] [ 0.240896 0.954043 0.135221 ] [ 0.247458 0.946713 0.640214 ] [ 0.753629 0.060259 0.3619 ] [ 0.759606 0.052632 0.866307 ] [ 0.74672 0.915229 0.35377 ] [ 0.773647 0.906889 0.860411 ] [ 0.250818 0.911207 0.015449 ] [ 0.248461 0.907311 0.518669 ] [ 0.247063 0.851607 0.229247 ] [ 0.240097 0.84315 0.732286 ] [ 0.935197 0.684483 0.100494 ] [ 0.561944 0.670848 0.103637 ] [ 0.936075 0.684137 0.601933 ] [ 0.562251 0.683447 0.612791 ] [ 0.753873 0.565657 0.297172 ] [ 0.252426 0.559421 0.41564 ] [ 0.764 0.567798 0.80028 ] [ 0.228427 0.568754 0.915293 ] [ 0.770559 0.424568 0.087082 ] [ 0.23236 0.42984 0.199133 ] [ 0.750187 0.432635 0.585549 ] [ 0.242442 0.433734 0.70378 ] [ 0.437304 0.307025 0.382022 ] [ 0.069019 0.304846 0.397886 ] [ 0.439246 0.322748 0.893977 ] [ 0.070322 0.303992 0.899165 ] [ 0.762608 0.146815 0.258404 ] [ 0.754945 0.137193 0.760689 ] [ 0.751624 0.122581 0.475395 ] [ 0.749536 0.118519 0.977257 ] [ 0.225499 0.094959 0.164102 ] [ 0.253776 0.086892 0.671279 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Li" "Li" "Li" "Li" "Fe" "Fe" "Fe" "Fe" "P" "P" "P" "P" "C" "C" "C" "C" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "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" 6.66255578 "source-unit" "angstrom" } "b" { "source-value" 8.85570565 "source-unit" "angstrom" } "c" { "source-value" 10.31479975 "source-unit" "angstrom" } "alpha" { "source-value" 88.36064618 "source-unit" "degree" } "beta" { "source-value" 89.54361688 "source-unit" "degree" } "gamma" { "source-value" 89.40483912 "source-unit" "degree" } }