.. _`apdx:dmrg`:


DMRG
====

Performs a DMRG computation through calls to Wouters's CheMPS2 library.

.. toctree::
   :hidden:
   :glob:

   dmrg__*


General
_______

.. include:: dmrg__dmrg_caspt2_calc.rst
.. include:: dmrg__dmrg_caspt2_imag.rst
.. include:: dmrg__dmrg_caspt2_ipea.rst
.. include:: dmrg__dmrg_caspt2_orbs.rst
.. include:: dmrg__dmrg_diis.rst
.. include:: dmrg__dmrg_diis_write.rst
.. include:: dmrg__dmrg_excitation.rst
.. include:: dmrg__dmrg_irrep.rst
.. include:: dmrg__dmrg_local_init.rst
.. include:: dmrg__dmrg_molden_write.rst
.. include:: dmrg__dmrg_mps_write.rst
.. include:: dmrg__dmrg_multiplicity.rst
.. include:: dmrg__dmrg_opdm_ao_print.rst
.. include:: dmrg__dmrg_print_corr.rst
.. include:: dmrg__dmrg_scf_active_space.rst
.. include:: dmrg__dmrg_scf_diis_thr.rst
.. include:: dmrg__dmrg_scf_grad_thr.rst
.. include:: dmrg__dmrg_scf_max_iter.rst
.. include:: dmrg__dmrg_scf_state_avg.rst
.. include:: dmrg__dmrg_sweep_dvdson_rtol.rst
.. include:: dmrg__dmrg_sweep_energy_conv.rst
.. include:: dmrg__dmrg_sweep_max_sweeps.rst
.. include:: dmrg__dmrg_sweep_noise_prefac.rst
.. include:: dmrg__dmrg_sweep_states.rst
.. include:: dmrg__dmrg_unitary_write.rst