{ "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" [ [ 0.623261 0.250991 0.724785 ] [ 0.376739 0.749009 0.275215 ] [ 0.005923 0.108042 0.313995 ] [ 0.994077 0.891958 0.686005 ] [ 0.288106 0.069503 0.354776 ] [ 0.711894 0.930497 0.645224 ] [ 0.915963 0.317588 0.464249 ] [ 0.084037 0.682412 0.535751 ] [ 0.085098 0.891608 0.17298 ] [ 0.914902 0.108392 0.82702 ] [ 0.741922 0.164935 0.255699 ] [ 0.258078 0.835065 0.744301 ] [ 0.394053 0.310659 0.616564 ] [ 0.605947 0.689341 0.383436 ] [ 0.647847 0.507305 0.779081 ] [ 0.352153 0.492695 0.220919 ] [ 0.411236 0.193312 0.944804 ] [ 0.588764 0.806688 0.055196 ] [ 0.92641 0.407919 0.066553 ] [ 0.07359 0.592081 0.933447 ] ] } "species" { "source-value" [ "Te" "Te" "Au" "Au" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 8.28870520045 "source-unit" "angstrom" } "b" { "source-value" 9.33507324246 "source-unit" "angstrom" } "c" { "source-value" 10.8830428098 "source-unit" "angstrom" } "alpha" { "source-value" 86.9112127852 "source-unit" "degree" } "beta" { "source-value" 70.4253152489 "source-unit" "degree" } "gamma" { "source-value" 82.1558250053 "source-unit" "degree" } }