{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4_12_12" } "basis-atom-coordinates" { "source-value" [ [ 0.686132 0.313868 0.25 ] [ 0.186132 0.186132 0.5 ] [ 0.313868 0.686132 0.75 ] [ 0.813868 0.813868 0 ] [ 0.823341 0.823341 0.5 ] [ 0.676659 0.323341 0.75 ] [ 0.323341 0.676659 0.25 ] [ 0.176659 0.176659 0 ] [ 0.290871 0.338128 0.227366 ] [ 0.161872 0.790871 0.477366 ] [ 0.790871 0.161872 0.522634 ] [ 0.838128 0.209129 0.977366 ] [ 0.209129 0.838128 0.022634 ] [ 0.661872 0.709129 0.272634 ] [ 0.338128 0.290871 0.772634 ] [ 0.709129 0.661872 0.727366 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Al" "Al" "Al" "Al" "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" 5.23013345 "source-unit" "angstrom" } "c" { "source-value" 6.32674163 "source-unit" "angstrom" } }