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.. | ||
create_ezfio_complex_3idx.py | ||
dump_2e_from_map.irp.f | ||
dump_ao_1e_cplx.irp.f | ||
dump_ao_2e_cplx.irp.f | ||
dump_ao_2e_from_df_all.irp.f | ||
dump_ao_2e_from_df.irp.f | ||
dump_df_ao.irp.f | ||
dump_df_mo.irp.f | ||
dump_kcon.irp.f | ||
dump_mo_2e_cplx.irp.f | ||
dump_mo_coef.irp.f | ||
export_integrals_ao_cplx.irp.f | ||
Gen_Ezfio_from_integral_complex_3idx.sh | ||
generate_pyscf_twists.py | ||
import_ao_2e_cplx.irp.f | ||
import_integrals_ao_cplx.irp.f | ||
import_kconserv.irp.f | ||
import_mo_coef_cplx.irp.f | ||
MolPyscfToQPkpts.py | ||
NEED | ||
qp2-pbc-diff.txt | ||
README.rst |
===== dummy ===== Module necessary to avoid the ``xxx is a root module but does not contain a main file`` message.