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.gitignore
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Initial commit
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2019-01-25 11:39:31 +01:00 |
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cis.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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cisd.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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configure.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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diagonalize_h.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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excited_states.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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fci.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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fcidump.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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four_idx_transform.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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interfaces.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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ks_scf.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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molden.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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natural_orbitals.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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plugins.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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print_e_conv.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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print_wf.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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printing.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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pt2.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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qp_convert_output_to_ezfio.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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qp_create_ezfio_from_xyz.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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qp_edit.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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qp_export_as_tgz.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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qp_plugins.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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qp_reset.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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qp_run.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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qp_set_frozen_core.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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qp_set_mo_class.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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qp_stop.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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qp_update.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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qpsh.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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rs_ks_scf.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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save_natorb.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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save_one_e_dm.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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save_ortho_mos.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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scf.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
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write_integrals_erf.1
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improved qp_e_conv_fci
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2019-02-06 18:22:08 +01:00 |
