.. _quest-qmc:

quest-qmc
=========

De acordo com a `página do quest-qmc <https://code.google.com/archive/p/quest-qmc/>`_,
"*QUantum Electron Simulation Toolbox (QUEST) is a Fortran 90/95 package that
implements the Determinant Quantum Monte Carlo (DQMC) method for quantum
electron simulations. The original versions of DQMC programs, developed by the
condensed matter theory group at UCSB including R. L Sugar, D. J. Scalapino, S.
R. White, and E. Y. Loh, and maintained by R. Scalettar, have been extensively
used to study magnetism, metal-insulator transitions, and superconductivity by
the Hubbard model*".

Versões disponíveis
-------------------

* quest-qmc/1.4.9


Submissão de Jobs em Serial
---------------------------

Crie um arquivo chamado, por exemplo, *submit_serial_jobs.sh*.

.. code-block:: bash

   #!/bin/bash
   #SBATCH -t 24:00:00

   export INPUT="input-test.in square.geom"
   export OUTPUT="*"
   
   module load quest-qmc/1.4.9
   job-nanny ggeom input-test.in

Para submeter o processo, basta usar o comando:

.. code-block:: bash

   sbatch submit_serial_jobs.sh


Referências
-----------

Para informações adicionais sobre o software, consulte a `documentação do quest-qmc <https://code.google.com/archive/p/quest-qmc/wikis/HowToUse.wiki>`_.