mirror of
https://github.com/QuantumPackage/qp2.git
synced 2024-11-16 11:03:49 +01:00
33 lines
469 B
ReStructuredText
33 lines
469 B
ReStructuredText
.. _qp_reset:
|
|
|
|
========
|
|
qp_reset
|
|
========
|
|
|
|
.. program:: qp_reset
|
|
|
|
This command resets parts of the |EZFIO| directory.
|
|
|
|
|
|
Usage
|
|
-----
|
|
|
|
.. code:: bash
|
|
|
|
qp_reset [-adhm] EZFIO_DIR
|
|
|
|
.. option:: -a, --all
|
|
|
|
Reset to the state in which the directory is after after running :ref:`qp_create_ezfio`.
|
|
|
|
.. option:: -d, --dets
|
|
|
|
Deletes the determinants and CI coefficients.
|
|
|
|
.. option:: -m, --mos
|
|
|
|
Deletes the |MOs|, and consequently the determinants and CI coefficients.
|
|
|
|
|
|
|