{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pbam" } "basis-atom-coordinates" { "source-value" [ [ 0 0.126032 0.150442 ] [ 0 0.873968 0.849558 ] [ 0 0.626032 0.349558 ] [ 0 0.373968 0.650442 ] [ 0 0.131772 0.412328 ] [ 0 0.868228 0.587672 ] [ 0 0.631772 0.087672 ] [ 0 0.368228 0.912328 ] [ 0.5 0.360054 0.467736 ] [ 0.5 0.639946 0.532264 ] [ 0.5 0.860054 0.032264 ] [ 0.5 0.139946 0.967736 ] [ 0.5 0.475713 0.189756 ] [ 0.5 0.524287 0.810244 ] [ 0.5 0.975713 0.310244 ] [ 0.5 0.024287 0.689756 ] [ 0.5 0.280527 0.316788 ] [ 0.5 0.719473 0.683212 ] [ 0.5 0.780527 0.183212 ] [ 0.5 0.219473 0.816788 ] [ 0.5 0.388819 0.045735 ] [ 0.5 0.611181 0.954265 ] [ 0.5 0.888819 0.454265 ] [ 0.5 0.111181 0.545735 ] ] } "species" { "source-value" [ "Gd" "Gd" "Gd" "Gd" "Fe" "Fe" "Fe" "Fe" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.40220742 "source-unit" "angstrom" } "b" { "source-value" 5.93202943 "source-unit" "angstrom" } "c" { "source-value" 11.47785776 "source-unit" "angstrom" } }