{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4_2/mnm" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.5 0 ] [ 0 0 0.5 ] [ 0.085234 0.337102 0 ] [ 0.337102 0.085234 0 ] [ 0.662898 0.914766 0 ] [ 0.914766 0.662898 0 ] [ 0.162898 0.585234 0.5 ] [ 0.414766 0.837102 0.5 ] [ 0.585234 0.162898 0.5 ] [ 0.837102 0.414766 0.5 ] [ 0.220019 0.779981 0 ] [ 0.779981 0.220019 0 ] [ 0.279981 0.279981 0.5 ] [ 0.720019 0.720019 0.5 ] ] } "species" { "source-value" [ "Dy" "Dy" "Ni" "Ni" "Ni" "Ni" "Ni" "Ni" "Ni" "Ni" "P" "P" "P" "P" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.09144631 "source-unit" "angstrom" } "c" { "source-value" 3.59824522 "source-unit" "angstrom" } }