{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/m" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.880559 0.5 0.302643 ] [ 0.119441 0.5 0.697357 ] [ 0.5 0.5 0 ] [ 0.380559 0 0.302643 ] [ 0.619441 0 0.697357 ] [ 0.213846 0.5 0.080676 ] [ 0.786154 0.5 0.919324 ] [ 0.098854 0 0.402868 ] [ 0.901146 0 0.597132 ] [ 0.713846 0 0.080676 ] [ 0.286154 0 0.919324 ] [ 0.598854 0.5 0.402868 ] [ 0.401146 0.5 0.597132 ] [ 0.18519 0.5 0.361418 ] [ 0.81481 0.5 0.638582 ] [ 0.68519 0 0.361418 ] [ 0.31481 0 0.638582 ] ] } "species" { "source-value" [ "Sm" "Sm" "Sm" "Sm" "Sm" "Sm" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ru" "Ru" "Ru" "Ru" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 10.98219302 "source-unit" "angstrom" } "b" { "source-value" 4.37056643 "source-unit" "angstrom" } "c" { "source-value" 8.31069267 "source-unit" "angstrom" } "beta" { "source-value" 109.10831997 "source-unit" "degree" } }