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55 lines
1.7 KiB
ReStructuredText
55 lines
1.7 KiB
ReStructuredText
================
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Electrons Module
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================
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Describes the electrons. For the moment, only the number of alpha and beta electrons
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are provided by this module.
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Assumptions
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===========
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.. Do not edit this section. It was auto-generated from the
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.. NEEDED_MODULES file.
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* ``elec_num`` >= 0
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* ``elec_alpha_num`` >= 0
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* ``elec_beta_num`` >= 0
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* ``elec_alpha_num`` >= ``elec_beta_num``
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Needed Modules
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==============
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.. Do not edit this section. It was auto-generated from the
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.. NEEDED_MODULES file.
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* `Ezfio_files <http://github.com/LCPQ/quantum_package/tree/master/src/Ezfio_files>`_
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* `Output <http://github.com/LCPQ/quantum_package/tree/master/src/Output>`_
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* `Utils <http://github.com/LCPQ/quantum_package/tree/master/src/Utils>`_
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Documentation
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=============
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.. Do not edit this section. It was auto-generated from the
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.. NEEDED_MODULES file.
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`elec_alpha_num <http://github.com/LCPQ/quantum_package/tree/master/src/Electrons/electrons.irp.f#L/BEGIN_PROVIDER [ integer, elec_alpha_num ]/;"
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>`_
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Numbers of alpha ("up") , beta ("down") and total electrons
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`elec_beta_num <http://github.com/LCPQ/quantum_package/tree/master/src/Electrons/electrons.irp.f#L/&BEGIN_PROVIDER [ integer, elec_beta_num ]/;"
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>`_
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Numbers of alpha ("up") , beta ("down") and total electrons
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`elec_num <http://github.com/LCPQ/quantum_package/tree/master/src/Electrons/electrons.irp.f#L/&BEGIN_PROVIDER [ integer, elec_num ]/;"
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>`_
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Numbers of alpha ("up") , beta ("down") and total electrons
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`elec_num_tab <http://github.com/LCPQ/quantum_package/tree/master/src/Electrons/electrons.irp.f#L/&BEGIN_PROVIDER [ integer, elec_num_tab, (2) ]/;"
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>`_
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Numbers of alpha ("up") , beta ("down") and total electrons
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