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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-12-23 20:13:42 +01:00
qp2/docs/source/modules
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.gitignore Develop (#15) 2019-03-07 16:29:06 +01:00
ao_basis.rst added extra basis 2024-12-04 15:58:59 +01:00
ao_one_e_ints.rst added extra basis 2024-12-04 15:58:59 +01:00
ao_two_e_erf_ints.rst Update documentation 2020-12-06 22:58:30 +01:00
ao_two_e_ints.rst added extra basis 2024-12-04 15:58:59 +01:00
aux_quantities.rst Update documentation and qp_set_frozne_core 2019-05-28 10:23:50 +02:00
becke_numerical_grid.rst added extra basis 2024-12-04 15:58:59 +01:00
bitmask.rst added extra basis 2024-12-04 15:58:59 +01:00
cipsi.rst added extra basis 2024-12-04 15:58:59 +01:00
cis.rst added extra basis 2024-12-04 15:58:59 +01:00
cisd.rst added extra basis 2024-12-04 15:58:59 +01:00
davidson_dressed.rst Develop (#15) 2019-03-07 16:29:06 +01:00
davidson_undressed.rst added extra basis 2024-12-04 15:58:59 +01:00
davidson.rst added extra basis 2024-12-04 15:58:59 +01:00
density_for_dft.rst added extra basis 2024-12-04 15:58:59 +01:00
determinants.rst added extra basis 2024-12-04 15:58:59 +01:00
dft_keywords.rst added extra basis 2024-12-04 15:58:59 +01:00
dft_one_e.rst added extra basis 2024-12-04 15:58:59 +01:00
dft_utils_in_r.rst added extra basis 2024-12-04 15:58:59 +01:00
dft_utils_one_e.rst Update documentation and qp_set_frozne_core 2019-05-28 10:23:50 +02:00
dressing.rst Develop (#15) 2019-03-07 16:29:06 +01:00
electrons.rst added extra basis 2024-12-04 15:58:59 +01:00
ezfio_files.rst added extra basis 2024-12-04 15:58:59 +01:00
fci.rst added extra basis 2024-12-04 15:58:59 +01:00
generators_cas.rst added extra basis 2024-12-04 15:58:59 +01:00
generators_full.rst added extra basis 2024-12-04 15:58:59 +01:00
hartree_fock.rst added extra basis 2024-12-04 15:58:59 +01:00
iterations.rst added extra basis 2024-12-04 15:58:59 +01:00
kohn_sham_rs.rst added extra basis 2024-12-04 15:58:59 +01:00
kohn_sham.rst added extra basis 2024-12-04 15:58:59 +01:00
mo_basis.rst added extra basis 2024-12-04 15:58:59 +01:00
mo_guess.rst added extra basis 2024-12-04 15:58:59 +01:00
mo_one_e_ints.rst added extra basis 2024-12-04 15:58:59 +01:00
mo_two_e_erf_ints.rst Update documentation 2020-12-06 22:58:30 +01:00
mo_two_e_ints.rst added extra basis 2024-12-04 15:58:59 +01:00
mpi.rst added extra basis 2024-12-04 15:58:59 +01:00
nuclei.rst added extra basis 2024-12-04 15:58:59 +01:00
perturbation.rst added extra basis 2024-12-04 15:58:59 +01:00
pseudo.rst added extra basis 2024-12-04 15:58:59 +01:00
psiref_cas.rst Develop (#15) 2019-03-07 16:29:06 +01:00
psiref_utils.rst Develop (#15) 2019-03-07 16:29:06 +01:00
scf_utils.rst added extra basis 2024-12-04 15:58:59 +01:00
selectors_cassd.rst Develop (#15) 2019-03-07 16:29:06 +01:00
selectors_full.rst Develop (#15) 2019-03-07 16:29:06 +01:00
selectors_utils.rst added extra basis 2024-12-04 15:58:59 +01:00
single_ref_method.rst Develop (#15) 2019-03-07 16:29:06 +01:00
tools.rst added extra basis 2024-12-04 15:58:59 +01:00
utils.rst added extra basis 2024-12-04 15:58:59 +01:00
zmq.rst added extra basis 2024-12-04 15:58:59 +01:00