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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-11-13 01:23:52 +01:00
QuantumPackage/docs/source/modules
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.gitignore Initial commit 2019-01-25 11:39:31 +01:00
ao_basis.rst Initial commit 2019-01-25 11:39:31 +01:00
ao_one_e_ints.rst Initial commit 2019-01-25 11:39:31 +01:00
ao_two_e_erf_ints.rst Included documentation 2019-01-25 14:54:38 +01:00
ao_two_e_ints.rst Included documentation 2019-01-25 14:54:38 +01:00
aux_quantities.rst Initial commit 2019-01-25 11:39:31 +01:00
becke_numerical_grid.rst Included documentation 2019-01-25 14:54:38 +01:00
bitmask.rst Included documentation 2019-01-25 14:54:38 +01:00
cipsi.rst Included documentation 2019-01-25 14:54:38 +01:00
cis.rst Initial commit 2019-01-25 11:39:31 +01:00
cisd.rst Initial commit 2019-01-25 11:39:31 +01:00
davidson_dressed.rst Initial commit 2019-01-25 11:39:31 +01:00
davidson_undressed.rst Initial commit 2019-01-25 11:39:31 +01:00
davidson.rst Included documentation 2019-01-25 14:54:38 +01:00
density_for_dft.rst Initial commit 2019-01-25 11:39:31 +01:00
determinants.rst Included documentation 2019-01-25 14:54:38 +01:00
dft_keywords.rst Initial commit 2019-01-25 11:39:31 +01:00
dft_utils_in_r.rst Initial commit 2019-01-25 11:39:31 +01:00
dft_utils_one_e.rst Initial commit 2019-01-25 11:39:31 +01:00
dressing.rst Initial commit 2019-01-25 11:39:31 +01:00
electrons.rst Initial commit 2019-01-25 11:39:31 +01:00
ezfio_files.rst Included documentation 2019-01-25 14:54:38 +01:00
fci.rst Included documentation 2019-01-25 14:54:38 +01:00
generators_cas.rst Initial commit 2019-01-25 11:39:31 +01:00
generators_full.rst Initial commit 2019-01-25 11:39:31 +01:00
hartree_fock.rst Included documentation 2019-01-25 14:54:38 +01:00
iterations.rst Included documentation 2019-01-25 14:54:38 +01:00
kohn_sham_rs.rst Included documentation 2019-01-25 14:54:38 +01:00
kohn_sham.rst Initial commit 2019-01-25 11:39:31 +01:00
mo_basis.rst Included documentation 2019-01-25 14:54:38 +01:00
mo_guess.rst Included documentation 2019-01-25 14:54:38 +01:00
mo_one_e_ints.rst Included documentation 2019-01-25 14:54:38 +01:00
mo_two_e_erf_ints.rst Included documentation 2019-01-25 14:54:38 +01:00
mo_two_e_ints.rst Included documentation 2019-01-25 14:54:38 +01:00
mpi.rst Included documentation 2019-01-25 14:54:38 +01:00
nuclei.rst Initial commit 2019-01-25 11:39:31 +01:00
perturbation.rst Included documentation 2019-01-25 14:54:38 +01:00
pseudo.rst Initial commit 2019-01-25 11:39:31 +01:00
psiref_cas.rst Initial commit 2019-01-25 11:39:31 +01:00
psiref_utils.rst Initial commit 2019-01-25 11:39:31 +01:00
scf_utils.rst Included documentation 2019-01-25 14:54:38 +01:00
selectors_cassd.rst Initial commit 2019-01-25 11:39:31 +01:00
selectors_full.rst Initial commit 2019-01-25 11:39:31 +01:00
selectors_utils.rst Initial commit 2019-01-25 11:39:31 +01:00
single_ref_method.rst Initial commit 2019-01-25 11:39:31 +01:00
tools.rst Included documentation 2019-01-25 14:54:38 +01:00
utils.rst Included documentation 2019-01-25 14:54:38 +01:00
zmq.rst Included documentation 2019-01-25 14:54:38 +01:00