{ "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" [ [ 0.479244 0.423506 0.75 ] [ 0.020756 0.923506 0.75 ] [ 0.520756 0.576494 0.25 ] [ 0.979244 0.076494 0.25 ] [ 0 0.5 0 ] [ 0.5 0 0.5 ] [ 0 0.5 0.5 ] [ 0.5 0 0 ] [ 0.696396 0.30653 0.448119 ] [ 0.803604 0.80653 0.051881 ] [ 0.303604 0.69347 0.551881 ] [ 0.196396 0.19347 0.948119 ] [ 0.196396 0.19347 0.551881 ] [ 0.303604 0.69347 0.948119 ] [ 0.803604 0.80653 0.448119 ] [ 0.696396 0.30653 0.051881 ] [ 0.104028 0.469445 0.25 ] [ 0.395972 0.969445 0.25 ] [ 0.604028 0.030555 0.75 ] [ 0.895972 0.530555 0.75 ] ] } "species" { "source-value" [ "Dy" "Dy" "Dy" "Dy" "Ni" "Ni" "Ni" "Ni" "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" 5.21545470082 "source-unit" "angstrom" } "b" { "source-value" 5.59934285 "source-unit" "angstrom" } "c" { "source-value" 7.47170820452 "source-unit" "angstrom" } }