Tour 3: Solving a quantum impurity model with QMC ---------------------------------------------------------- `[Requires TRIQS and the application cthyb_matrix]` Free electrons are nice, but the `I` in TRIQS means `interacting`. So let us solve a simple one-band Anderson impurity model .. math:: \mathcal{H}_\mathrm{loc} = U n_\uparrow n_\downarrow, where the non-interacting Green's function is: .. math:: G^{-1}_{0,\sigma} (i \omega_n) = i \omega_n - \epsilon_f - V^2 \Gamma_\sigma(i \omega_n). In this example, an impurity with the non-interacting level position at energy :math:`\epsilon_f` and on-site Coulomb repulsion :math:`U` is embedded into an electronic bath. The electronic bath has a flat density of states over the interval :math:`[-1,1]` and hybridizes with the impurity with the amplitude :math:`V`. We solve this model using the hybridization expansion Continuous Time Quantum Monte Carlo method (CT-Hyb) proposed by `P. Werner et al. `_ To this end we first initialize the ``Solver`` class of the TRIQS CT-Hyb implementaion ``pytriqs.applications.impurity_solvers.cthyb_matrix``. Then, after having constructed the non-interacting Green's function :math:`G^{-1}_{0,\sigma}`, we launch the impurity solver calculations by calling the ``Solve`` method. Finally, the resulting interacting Green's function as well as average impurity occupancy is stored in the :ref:`HDF5 format`. .. literalinclude:: ./aim.py The result can be then read from the ``HDF5`` file and plotted using the ``oplot`` function: .. literalinclude:: aim_plot.py .. image:: aim_plot1.png :width: 700 :align: center We go through this example in more details in the documentation of the cthyb_matrix application.