.. _qp_run: ====== qp_run ====== .. TODO .. program:: qp_run Command used to run a calculation. If the ``USR1`` signal is sent to :ref:`qp_run`, the application will call :ref:`qp_stop` to request a clean termination. In a SLURM script, you can ask SLURM to send the ``USR1`` signal 120 seconds before end of the time limit with :: #SBATCH --signal=B:USR1@120 There is a directory named :file:`work` in the |EZFIO|. This directory will contain work files which can be large, so it is recommended to work in the scratch directory. To archive the |EZFIO| directory, it is recommended to remove the :file:`work` directory. Usage ----- .. code:: bash qp_run [-h] [-p ] [-s] [--] PROGRAM EZFIO_DIR ``PROGRAM`` is the name of the |QP| program to be run, and ``EZFIO_DIR`` is the name of the |EZFIO| directory containing the data. .. option:: -h, --help Displays the list of available |qp| programs. .. option:: -p , --prefix= Prefix before running the program. This option is used to run programs like like gdb or valgrind. .. option:: -s, --slave This option needs to be set to run a slave job for ``PROGRAM``, to accelerate another running instance of the |qp|. Example ------- .. code:: bash qp_run fci h2o.ezfio & srun qp_run --slave fci h2o.ezfio wait