{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pbam" } "basis-atom-coordinates" { "source-value" [ [ 0 0.15665 0.184152 ] [ 0 0.34335 0.684152 ] [ 0 0.65665 0.315848 ] [ 0 0.84335 0.815848 ] [ 0.256587 0 0.5 ] [ 0.743413 0 0.5 ] [ 0.5 0.138309 0.835744 ] [ 0.5 0.361691 0.335744 ] [ 0.256587 0.5 0 ] [ 0.743413 0.5 0 ] [ 0.5 0.638309 0.664256 ] [ 0.5 0.861691 0.164256 ] [ 0.5 0 0 ] [ 0.751492 0.099698 0.716951 ] [ 0.248508 0.099698 0.716951 ] [ 0.5 0.14872 0.426886 ] [ 0 0.15848 0.451154 ] [ 0 0.34152 0.951154 ] [ 0.5 0.35128 0.926886 ] [ 0.248508 0.400302 0.216951 ] [ 0.751492 0.400302 0.216951 ] [ 0.5 0.5 0.5 ] [ 0.248508 0.599698 0.783049 ] [ 0.751492 0.599698 0.783049 ] [ 0.5 0.64872 0.073114 ] [ 0 0.65848 0.048846 ] [ 0 0.84152 0.548846 ] [ 0.5 0.85128 0.573114 ] [ 0.248508 0.900302 0.283049 ] [ 0.751492 0.900302 0.283049 ] ] } "species" { "source-value" [ "Eu" "Eu" "Eu" "Eu" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "O" "O" "O" "O" "O" "O" "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" 5.75232775 "source-unit" "angstrom" } "b" { "source-value" 7.53177229 "source-unit" "angstrom" } "c" { "source-value" 8.43920268 "source-unit" "angstrom" } }