{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnb" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.764558 0.415922 ] [ 0.75 0.235442 0.584078 ] [ 0.25 0.264558 0.084078 ] [ 0.75 0.735442 0.915922 ] [ 0.25 0.988497 0.654463 ] [ 0.75 0.011503 0.345537 ] [ 0.25 0.488497 0.845537 ] [ 0.75 0.511503 0.154463 ] [ 0.75 0.142144 0.91726 ] [ 0.25 0.857856 0.08274 ] [ 0.75 0.642144 0.58274 ] [ 0.25 0.357856 0.41726 ] ] } "species" { "source-value" [ "Pb" "Pb" "Pb" "Pb" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.57924101 "source-unit" "angstrom" } "b" { "source-value" 7.78987344 "source-unit" "angstrom" } "c" { "source-value" 9.35574134 "source-unit" "angstrom" } }