{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4/mbm" } "basis-atom-coordinates" { "source-value" [ [ 0.822018 0.677982 0.5 ] [ 0.177982 0.322018 0.5 ] [ 0.322018 0.822018 0.5 ] [ 0.677982 0.177982 0.5 ] [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0.881847 0.381847 0 ] [ 0.118153 0.618153 0 ] [ 0.381847 0.118153 0 ] [ 0.618153 0.881847 0 ] ] } "species" { "source-value" [ "Dy" "Dy" "Dy" "Dy" "Mg" "Mg" "Si" "Si" "Si" "Si" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.16017122 "source-unit" "angstrom" } "c" { "source-value" 4.22644505 "source-unit" "angstrom" } }