{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pnam" } "basis-atom-coordinates" { "source-value" [ [ 0.336115 0.514676 0.875604 ] [ 0.336115 0.985324 0.875604 ] [ 0.836115 0.485324 0.624396 ] [ 0.836115 0.014676 0.624396 ] [ 0.163885 0.514676 0.375604 ] [ 0.163885 0.985324 0.375604 ] [ 0.663885 0.485324 0.124396 ] [ 0.663885 0.014676 0.124396 ] [ 0.869433 0.25 0.950602 ] [ 0.866743 0.75 0.813154 ] [ 0.366743 0.25 0.686846 ] [ 0.369433 0.75 0.549398 ] [ 0.630567 0.25 0.450602 ] [ 0.633257 0.75 0.313154 ] [ 0.133257 0.25 0.186846 ] [ 0.130567 0.75 0.049398 ] [ 0.693918 0.07192 0.950166 ] [ 0.693918 0.42808 0.950166 ] [ 0.077643 0.75 0.917299 ] [ 0.164816 0.25 0.892408 ] [ 0.546943 0.75 0.844794 ] [ 0.993891 0.571616 0.763776 ] [ 0.993891 0.928384 0.763776 ] [ 0.493891 0.428384 0.736224 ] [ 0.493891 0.071616 0.736224 ] [ 0.046943 0.25 0.655206 ] [ 0.664816 0.75 0.607592 ] [ 0.577643 0.25 0.582701 ] [ 0.193918 0.92808 0.549834 ] [ 0.193918 0.57192 0.549834 ] [ 0.806082 0.07192 0.450166 ] [ 0.806082 0.42808 0.450166 ] [ 0.422357 0.75 0.417299 ] [ 0.335184 0.25 0.392408 ] [ 0.953057 0.75 0.344794 ] [ 0.506109 0.571616 0.263776 ] [ 0.506109 0.928384 0.263776 ] [ 0.006109 0.428384 0.236224 ] [ 0.006109 0.071616 0.236224 ] [ 0.453057 0.25 0.155206 ] [ 0.835184 0.75 0.107592 ] [ 0.922357 0.25 0.082701 ] [ 0.306082 0.92808 0.049834 ] [ 0.306082 0.57192 0.049834 ] ] } "species" { "source-value" [ "Dy" "Dy" "Dy" "Dy" "Dy" "Dy" "Dy" "Dy" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "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" 5.2886045 "source-unit" "angstrom" } "b" { "source-value" 8.303066 "source-unit" "angstrom" } "c" { "source-value" 13.95380643 "source-unit" "angstrom" } }