{ "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" [ [ 0.015467 0.940716 0.75 ] [ 0.484533 0.440716 0.75 ] [ 0.515467 0.559284 0.25 ] [ 0.984533 0.059284 0.25 ] [ 0 0.5 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0 ] [ 0.5 0 0.5 ] [ 0.093972 0.472679 0.25 ] [ 0.203003 0.203916 0.54919 ] [ 0.203003 0.203916 0.95081 ] [ 0.296997 0.703916 0.95081 ] [ 0.296997 0.703916 0.54919 ] [ 0.406028 0.972679 0.25 ] [ 0.593972 0.027321 0.75 ] [ 0.703003 0.296084 0.04919 ] [ 0.703003 0.296084 0.45081 ] [ 0.796997 0.796084 0.04919 ] [ 0.796997 0.796084 0.45081 ] [ 0.906028 0.527321 0.75 ] ] } "species" { "source-value" [ "Er" "Er" "Er" "Er" "Al" "Al" "Al" "Al" "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" 5.17637779 "source-unit" "angstrom" } "b" { "source-value" 5.3796555 "source-unit" "angstrom" } "c" { "source-value" 7.40977449 "source-unit" "angstrom" } }