{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.781915 0.75 0.369598 ] [ 0.218085 0.25 0.630402 ] [ 0.247219 0.489175 0.219356 ] [ 0.247219 0.010825 0.219356 ] [ 0.752781 0.510825 0.780644 ] [ 0.752781 0.989175 0.780644 ] [ 0.710403 0.25 0.430871 ] [ 0.289597 0.75 0.569129 ] [ 0.728665 0.75 0.094329 ] [ 0.271335 0.25 0.905671 ] [ 0.302024 0.25 0.030722 ] [ 0.93282 0.75 0.154131 ] [ 0.555753 0.75 0.177013 ] [ 0.772165 0.071002 0.353159 ] [ 0.772165 0.428998 0.353159 ] [ 0.156297 0.75 0.430493 ] [ 0.447626 0.25 0.45575 ] [ 0.552374 0.75 0.54425 ] [ 0.843703 0.25 0.569507 ] [ 0.227835 0.571002 0.646841 ] [ 0.227835 0.928998 0.646841 ] [ 0.444247 0.25 0.822987 ] [ 0.06718 0.25 0.845869 ] [ 0.697976 0.75 0.969278 ] ] } "species" { "source-value" [ "Tb" "Tb" "K" "K" "K" "K" "P" "P" "C" "C" "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" 5.85054295 "source-unit" "angstrom" } "b" { "source-value" 7.17082933 "source-unit" "angstrom" } "c" { "source-value" 10.02795377 "source-unit" "angstrom" } "beta" { "source-value" 91.97332437 "source-unit" "degree" } }