mirror of
https://github.com/LCPQ/quantum_package
synced 2024-10-20 06:48:20 +02:00
0142a2402e
* added becke_numerical_grid/example.irp.f * added exemples for determinants and bitmask * added density_for_dft, dft_keywords and data_energy_and_density * added dft_utils_one_body * added dft_utils_two_body and it compilates |
||
|---|---|---|
| .. | ||
| ao_bi_integrals_erf.irp.f | ||
| ao_bielec_integrals_erf_in_map_slave.irp.f | ||
| EZFIO.cfg | ||
| integrals_3_index_erf.irp.f | ||
| map_integrals_erf.irp.f | ||
| mo_bi_integrals_erf.irp.f | ||
| NEED | ||
| providers_ao_erf.irp.f | ||
| qp_ao_erf_ints.irp.f | ||
| read_write.irp.f | ||
| routines_save_integrals_erf.irp.f | ||
| write_integrals_erf.irp.f | ||
| write_ints_erf_to_regular_ints.irp.f | ||