{ "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" [ [ 0.974422 0.001299 0.016849 ] [ 0.981185 0.670442 0.666663 ] [ 0.507982 0.147221 0.665829 ] [ 0.021311 0.316858 0.342913 ] [ 0.497683 0.511722 0.995441 ] [ 0.486791 0.785483 0.368657 ] [ 0.71227 0.34241 0.831487 ] [ 0.268684 0.784884 0.832327 ] [ 0.762955 0.509438 0.47875 ] [ 0.742153 0.799965 0.899173 ] [ 0.759765 0.9895 0.514747 ] [ 0.252948 0.995166 0.490302 ] [ 0.249098 0.23804 0.04163 ] [ 0.264084 0.487559 0.52407 ] [ 0.736161 0.268995 0.159477 ] [ 0.282508 0.651019 0.171684 ] ] } "species" { "source-value" [ "La" "La" "La" "La" "Bi" "Bi" "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" 5.72205184 "source-unit" "angstrom" } "b" { "source-value" 5.77438971 "source-unit" "angstrom" } "c" { "source-value" 8.80612112 "source-unit" "angstrom" } "alpha" { "source-value" 71.71955252 "source-unit" "degree" } "beta" { "source-value" 86.36333212 "source-unit" "degree" } "gamma" { "source-value" 86.52152769 "source-unit" "degree" } }