{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Immm" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0.871018 ] [ 0 0 0.128982 ] [ 0 0.5 0 ] [ 0.5 0.5 0.371018 ] [ 0.5 0.5 0.628982 ] [ 0.5 0 0.5 ] [ 0.5 0.308196 0.828873 ] [ 0.5 0.691804 0.828873 ] [ 0.5 0.691804 0.171127 ] [ 0.5 0.308196 0.171127 ] [ 0 0.808196 0.328873 ] [ 0 0.191804 0.328873 ] [ 0 0.191804 0.671127 ] [ 0 0.808196 0.671127 ] [ 0.5 0.8066 0 ] [ 0 0.5 0.783567 ] [ 0 0.5 0.216433 ] [ 0.5 0.1934 0 ] [ 0 0.3066 0.5 ] [ 0.5 0 0.283567 ] [ 0.5 0 0.716433 ] [ 0 0.6934 0.5 ] ] } "species" { "source-value" [ "Er" "Er" "Er" "Er" "Er" "Er" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "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" 4.17453212341 "source-unit" "angstrom" } "b" { "source-value" 6.64130934892 "source-unit" "angstrom" } "c" { "source-value" 13.8293631356 "source-unit" "angstrom" } }