{ "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" [ [ 0.450807 0.540898 0.505927 ] [ 0.004716 0.946278 0.015493 ] [ 0.757251 0.715012 0.737685 ] [ 0.253122 0.186695 0.275069 ] [ 0.47464 0.355561 0.659489 ] [ 0.198603 0.111035 0.469487 ] [ 0.086739 0.970586 0.824747 ] [ 0.949443 0.873837 0.198287 ] [ 0.847363 0.725904 0.54548 ] [ 0.559205 0.503587 0.353468 ] [ 0.327811 0.289107 0.031367 ] ] } "species" { "source-value" [ "Ta" "Bi" "Bi" "Bi" "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" 3.76927863542 "source-unit" "angstrom" } "b" { "source-value" 3.92543461341 "source-unit" "angstrom" } "c" { "source-value" 12.8822326914 "source-unit" "angstrom" } "alpha" { "source-value" 81.5971963094 "source-unit" "degree" } "beta" { "source-value" 81.6670995968 "source-unit" "degree" } "gamma" { "source-value" 61.925897266 "source-unit" "degree" } }