{ "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" [ [ 0.920167 0.238535 0.123053 ] [ 0.26386 0.880351 0.626669 ] [ 0.620832 0.739035 0.368532 ] [ 0.124221 0.372507 0.752298 ] [ 0.750842 0.622676 0.879707 ] [ 0.373544 0.137384 0.243841 ] [ 0.834565 0.508916 0.518707 ] [ 0.995093 0.992296 0.805748 ] [ 0.999036 0.993369 0.331903 ] [ 0.171322 0.682007 0.169526 ] [ 0.659562 0.182846 0.681283 ] [ 0.334182 0.507383 0.51593 ] [ 0.488763 0.815216 0.99271 ] [ 0.06267 0.450831 0.283078 ] [ 0.287764 0.704654 0.655836 ] [ 0.646593 0.556559 0.347358 ] [ 0.065044 0.836942 0.641917 ] [ 0.873834 0.190389 0.912186 ] [ 0.193248 0.865097 0.412367 ] [ 0.465142 0.069104 0.778249 ] [ 0.939447 0.789877 0.086332 ] [ 0.407602 0.689042 0.351496 ] [ 0.769321 0.934641 0.575615 ] [ 0.666964 0.80744 0.220755 ] [ 0.718073 0.424372 0.876591 ] [ 0.157735 0.213398 0.800703 ] [ 0.201962 0.165062 0.285803 ] [ 0.819565 0.071082 0.157903 ] [ 0.35264 0.92238 0.18175 ] [ 0.148653 0.335345 0.562444 ] [ 0.914496 0.363912 0.693171 ] [ 0.272264 0.582073 0.944682 ] [ 0.553531 0.641817 0.824752 ] [ 0.578006 0.279761 0.450643 ] [ 0.812556 0.665203 0.727463 ] ] } "species" { "source-value" [ "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "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" 9.13807237 "source-unit" "angstrom" } "b" { "source-value" 9.24570497 "source-unit" "angstrom" } "c" { "source-value" 9.26325694 "source-unit" "angstrom" } "alpha" { "source-value" 107.84723781 "source-unit" "degree" } "beta" { "source-value" 110.3225465 "source-unit" "degree" } "gamma" { "source-value" 109.36182997 "source-unit" "degree" } }