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31 lines
470 B
ReStructuredText
31 lines
470 B
ReStructuredText
.. _qp_stop:
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=======
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qp_stop
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=======
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.. program:: qp_stop
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Requests for a clean termination of the program.
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This will have the effect to exit the Davidson diagonalization, the
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|SCF| procedure or the determinant selection to save the current wave
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function and exit the program.
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Usage
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-----
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.. code:: bash
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qp_stop [-chq] EZFIO_DIR
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.. option:: -c, --cancel
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Cancel the qp_stop order.
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.. option:: -q, --query
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Ask if :file:`EZFIO_DIR` was requested to stop.
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