{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pc" } "basis-atom-coordinates" { "source-value" [ [ 0.016297 0.769156 0.536969 ] [ 0.979996 0.017335 0.73416 ] [ 0.979996 0.982665 0.23416 ] [ 0.016297 0.230844 0.036969 ] [ 0.473779 0.46162 0.941986 ] [ 0.473779 0.53838 0.441986 ] [ 0.532175 0.762038 0.658156 ] [ 0.004818 0.712215 0.997484 ] [ 0.532175 0.237962 0.158156 ] [ 0.004818 0.287785 0.497484 ] [ 0.446692 0.757429 0.17501 ] [ 0.490287 0.992026 0.405324 ] [ 0.490287 0.007974 0.905324 ] [ 0.446692 0.242571 0.67501 ] [ 0.950886 0.53308 0.288007 ] [ 0.950886 0.46692 0.788007 ] [ 0.818502 0.821095 0.654214 ] [ 0.39204 0.756242 0.542189 ] [ 0.015503 0.720635 0.126462 ] [ 0.289887 0.698076 0.958356 ] [ 0.738235 0.799613 0.301479 ] [ 0.254524 0.735929 0.322823 ] [ 0.881997 0.911321 0.94911 ] [ 0.373111 0.917779 0.730464 ] [ 0.373111 0.082221 0.230464 ] [ 0.881997 0.088679 0.44911 ] [ 0.818502 0.178905 0.154214 ] [ 0.015503 0.279365 0.626462 ] [ 0.289887 0.301924 0.458356 ] [ 0.39204 0.243758 0.042189 ] [ 0.254524 0.264071 0.822823 ] [ 0.738235 0.200387 0.801479 ] [ 0.85461 0.487716 0.458364 ] [ 0.516717 0.448418 0.219488 ] [ 0.516717 0.551582 0.719488 ] [ 0.85461 0.512284 0.958364 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Si" "Si" "Si" "Si" "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "O" "O" "O" "O" "O" "O" "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" 5.45506425 "source-unit" "angstrom" } "b" { "source-value" 6.90548241 "source-unit" "angstrom" } "c" { "source-value" 12.90988434 "source-unit" "angstrom" } "beta" { "source-value" 91.72836427 "source-unit" "degree" } }