{ "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" [ [ 0.162024 0.504863 0.149786 ] [ 0.837976 0.495137 0.850214 ] [ 0.263965 0.251496 0.004006 ] [ 0.736035 0.748504 0.995994 ] [ 0.356666 0.033332 0.811511 ] [ 0.199363 0.705518 0.572035 ] [ 0.643334 0.966668 0.188489 ] [ 0.800637 0.294482 0.427965 ] ] } "species" { "source-value" [ "Te" "Te" "Pd" "Pd" "I" "I" "I" "I" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.43912613337 "source-unit" "angstrom" } "b" { "source-value" 7.2522681565 "source-unit" "angstrom" } "c" { "source-value" 9.28707004213 "source-unit" "angstrom" } "alpha" { "source-value" 68.3169471614 "source-unit" "degree" } "beta" { "source-value" 80.7570446822 "source-unit" "degree" } "gamma" { "source-value" 82.7622754752 "source-unit" "degree" } }