{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pbnm" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0 0.5 ] [ 0.5 0 0 ] [ 0 0.5 0.5 ] [ 0 0.5 0 ] [ 0.484379 0.559404 0.75 ] [ 0.515621 0.440596 0.25 ] [ 0.984379 0.940596 0.25 ] [ 0.015621 0.059404 0.75 ] [ 0.299012 0.29616 0.960523 ] [ 0.424322 0.015984 0.25 ] [ 0.575678 0.984016 0.75 ] [ 0.075678 0.515984 0.25 ] [ 0.700988 0.70384 0.039477 ] [ 0.799012 0.20384 0.039477 ] [ 0.924322 0.484016 0.75 ] [ 0.200988 0.79616 0.539477 ] [ 0.700988 0.70384 0.460523 ] [ 0.799012 0.20384 0.460523 ] [ 0.299012 0.29616 0.539477 ] [ 0.200988 0.79616 0.960523 ] ] } "species" { "source-value" [ "Yb" "Yb" "Yb" "Yb" "Rb" "Rb" "Rb" "Rb" "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" 7.8189689 "source-unit" "angstrom" } "b" { "source-value" 8.09213764 "source-unit" "angstrom" } "c" { "source-value" 11.28297161 "source-unit" "angstrom" } }