{ "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" [ [ 0.677869 0.184001 0.405185 ] [ 0.322131 0.815999 0.594815 ] [ 0.901538 0.248477 0.969382 ] [ 0.345646 0.376795 0.772088 ] [ 0.654354 0.623205 0.227912 ] [ 0.098462 0.751523 0.030618 ] [ 0 0 0 ] [ 0.738158 0.536048 0.956212 ] [ 0.261842 0.463952 0.043788 ] [ 0.492515 0.109664 0.80725 ] [ 0.945711 0.199049 0.667281 ] [ 0.379234 0.293475 0.499249 ] [ 0.805203 0.350498 0.248643 ] [ 0.194797 0.649502 0.751357 ] [ 0.620766 0.706525 0.500751 ] [ 0.054289 0.800951 0.332719 ] [ 0.507485 0.890336 0.19275 ] ] } "species" { "source-value" [ "Li" "Li" "Co" "Co" "Co" "Co" "O" "O" "O" "F" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.05438873 "source-unit" "angstrom" } "b" { "source-value" 6.53874439 "source-unit" "angstrom" } "c" { "source-value" 6.84121132 "source-unit" "angstrom" } "alpha" { "source-value" 108.76494275 "source-unit" "degree" } "beta" { "source-value" 104.14120429 "source-unit" "degree" } "gamma" { "source-value" 96.74081805 "source-unit" "degree" } }