{ "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" [ [ 0.981783 0.046434 0.747544 ] [ 0.514445 0.546313 0.747661 ] [ 0.485555 0.453687 0.252339 ] [ 0.018217 0.953566 0.252456 ] [ 0 0.5 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0 ] [ 0.5 0 0.5 ] [ 0.8934 0.541886 0.243764 ] [ 0.794758 0.794026 0.559053 ] [ 0.793719 0.795007 0.942705 ] [ 0.695958 0.286589 0.941765 ] [ 0.703441 0.292837 0.560262 ] [ 0.607287 0.041087 0.253205 ] [ 0.392713 0.958913 0.746795 ] [ 0.296559 0.707163 0.439738 ] [ 0.304042 0.713411 0.058235 ] [ 0.206281 0.204993 0.057295 ] [ 0.205242 0.205974 0.440947 ] [ 0.1066 0.458114 0.756236 ] ] } "species" { "source-value" [ "Tl" "Tl" "Tl" "Tl" "Co" "Co" "Co" "Co" "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" 5.32707597 "source-unit" "angstrom" } "b" { "source-value" 5.40994852 "source-unit" "angstrom" } "c" { "source-value" 7.92476064 "source-unit" "angstrom" } "alpha" { "source-value" 89.48993524 "source-unit" "degree" } "beta" { "source-value" 89.53109195 "source-unit" "degree" } "gamma" { "source-value" 89.13552738 "source-unit" "degree" } }