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| .. | ||
| diagonalize_h.irp.f | ||
| fcidump_pyscf.irp.f | ||
| fcidump.irp.f | ||
| four_idx_transform.irp.f | ||
| hcore_guess.irp.f | ||
| huckel_guess.irp.f | ||
| molden.irp.f | ||
| NEED | ||
| print_ci_vectors.irp.f | ||
| print_dipole.irp.f | ||
| print_e_conv.irp.f | ||
| print_energy.irp.f | ||
| print_hamiltonian.irp.f | ||
| print_var_energy.irp.f | ||
| print_wf.irp.f | ||
| README.rst | ||
| rotate_mos.irp.f | ||
| save_natorb_no_ov_rot.irp.f | ||
| save_natorb_no_ref.irp.f | ||
| save_natorb.irp.f | ||
| save_one_e_dm.irp.f | ||
| save_ortho_mos.irp.f | ||
| sort_by_fock_energies.irp.f | ||
| swap_mos.irp.f | ||
| truncate_wf.irp.f | ||
| write_integrals_erf.irp.f | ||
===== tools ===== Useful tools are grouped in this module.