{ "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" [ [ 0.109335 0.849152 0.180097 ] [ 0.890665 0.150848 0.819903 ] [ 0.230697 0.565423 0.935128 ] [ 0.856151 0.135494 0.356936 ] [ 0.143849 0.864506 0.643064 ] [ 0.630571 0.702124 0.732602 ] [ 0.369429 0.297876 0.267398 ] [ 0.617527 0.697901 0.332195 ] [ 0.382473 0.302099 0.667805 ] [ 0.769303 0.434577 0.064872 ] [ 0.5 0 0.5 ] [ 0.899524 0.470406 0.592121 ] [ 0.413912 0.107217 0.979396 ] [ 0.586088 0.892783 0.020604 ] [ 0.100476 0.529594 0.407879 ] [ 0.761813 0.931022 0.568789 ] [ 0.67904 0.713656 0.044531 ] [ 0.32096 0.286344 0.955469 ] [ 0.293718 0.893641 0.959164 ] [ 0.706282 0.106359 0.040836 ] [ 0.238187 0.068978 0.431211 ] [ 0.802345 0.443576 0.761349 ] [ 0.197655 0.556424 0.238651 ] [ 0.799931 0.440388 0.368398 ] [ 0.200069 0.559612 0.631602 ] ] } "species" { "source-value" [ "Sr" "Sr" "Sr" "Sr" "Sr" "Sr" "Sr" "Sr" "Sr" "Sr" "Fe" "Fe" "Fe" "Fe" "Fe" "N" "N" "N" "N" "N" "N" "N" "N" "N" "N" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.55185396696 "source-unit" "angstrom" } "b" { "source-value" 8.66721287399 "source-unit" "angstrom" } "c" { "source-value" 8.89040513529 "source-unit" "angstrom" } "alpha" { "source-value" 90.1280434013 "source-unit" "degree" } "beta" { "source-value" 109.550654516 "source-unit" "degree" } "gamma" { "source-value" 102.254962906 "source-unit" "degree" } }