{ "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" [ [ 0.662895 0.333511 0.883014 ] [ 0.981303 0.95977 0.98556 ] [ 0.991972 0.982575 0.504295 ] [ 0.32455 0.653184 0.402599 ] [ 0.681365 0.353232 0.505698 ] [ 0.348863 0.703942 0.973419 ] [ 0.829221 0.658552 0.215595 ] [ 0.170118 0.832338 0.712619 ] [ 0.663467 0.835898 0.713229 ] [ 0.336531 0.1674 0.216012 ] [ 0.830879 0.167374 0.215188 ] [ 0.174359 0.345095 0.715484 ] [ 0.336098 0.187569 0.594366 ] [ 0.515289 0.026071 0.335823 ] [ 0.657036 0.318767 0.101213 ] [ 0.003324 0.004292 0.317159 ] [ 0.019284 0.009023 0.804462 ] [ 0.84723 0.174636 0.596842 ] [ 0.509776 0.470975 0.339787 ] [ 0.961655 0.468838 0.339145 ] [ 0.153432 0.30961 0.102874 ] [ 0.856831 0.677822 0.599219 ] [ 0.033906 0.509272 0.846354 ] [ 0.480625 0.521257 0.846222 ] [ 0.318862 0.664817 0.608866 ] [ 0.170332 0.847335 0.100172 ] [ 0.463238 0.966172 0.83569 ] [ 0.677258 0.850671 0.096934 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Fe" "Fe" "Ni" "Ni" "Ni" "Sb" "Sb" "Sb" "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" 6.03404374 "source-unit" "angstrom" } "b" { "source-value" 6.06493381 "source-unit" "angstrom" } "c" { "source-value" 9.66172673 "source-unit" "angstrom" } "alpha" { "source-value" 91.49407216 "source-unit" "degree" } "beta" { "source-value" 90.51973941 "source-unit" "degree" } "gamma" { "source-value" 119.68782568 "source-unit" "degree" } }