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qp2/src/hartree_fock
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10.hf.bats Initial commit 2019-01-25 11:39:31 +01:00
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fock_matrix_hf.irp.f Initial commit 2019-01-25 11:39:31 +01:00
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scf.irp.f Initial commit 2019-01-25 11:39:31 +01:00

============
hartree_fock
============


The :ref:`scf` program performs *Restricted* Hartree-Fock
calculations (the spatial part of the |MOs| is common for alpha and beta
spinorbitals).

The Hartree-Fock algorithm is a |SCF| and therefore is based on the
:ref:`module_scf_utils` module. 

The Fock matrix is defined in :file:`fock_matrix_hf.irp.f`.