{ "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" [ [ 0.932414 0.5 0.774774 ] [ 0.067586 0.5 0.225226 ] [ 0.238858 0.5 0.144243 ] [ 0.761142 0.5 0.855757 ] [ 0.432414 0 0.774774 ] [ 0.567586 0 0.225226 ] [ 0.738858 0 0.144243 ] [ 0.261142 0 0.855757 ] [ 0.232064 0 0.362526 ] [ 0.938059 0 0.200817 ] [ 0.767936 0 0.637474 ] [ 0.580223 0 0.518246 ] [ 0.061941 0 0.799183 ] [ 0.419777 0 0.481754 ] [ 0.732064 0.5 0.362526 ] [ 0.438059 0.5 0.200817 ] [ 0.267936 0.5 0.637474 ] [ 0.080223 0.5 0.518246 ] [ 0.561941 0.5 0.799183 ] [ 0.919777 0.5 0.481754 ] [ 0.083679 0 0.044698 ] [ 0.154312 0 0.485357 ] [ 0.916321 0 0.955302 ] [ 0.882715 0.5 0.224372 ] [ 0.845688 0 0.514643 ] [ 0.117285 0.5 0.775628 ] [ 0.583679 0.5 0.044698 ] [ 0.654312 0.5 0.485357 ] [ 0.416321 0.5 0.955302 ] [ 0.382715 0 0.224372 ] [ 0.345688 0.5 0.514643 ] [ 0.617285 0 0.775628 ] ] } "species" { "source-value" [ "Yb" "Yb" "Yb" "Yb" "Yb" "Yb" "Yb" "Yb" "Zn" "Zn" "Zn" "Zn" "Zn" "Zn" "Zn" "Zn" "Zn" "Zn" "Zn" "Zn" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 18.7480104166 "source-unit" "angstrom" } "b" { "source-value" 4.31030960233 "source-unit" "angstrom" } "c" { "source-value" 11.6203077812 "source-unit" "angstrom" } "beta" { "source-value" 137.181992547 "source-unit" "degree" } }