vibeqc.run_aiccm2026dev_b_dlpno_ccsd_t¶

vibeqc.run_aiccm2026dev_b_dlpno_ccsd_t(system, basis, mesh=(1, 1, 1), options=None, *, cc_options=None, aux_basis=None, lattice_cutoff_bohr=15.0, rsgdf_ke_cutoff=200.0, gdf_linear_dep_threshold=1e-09, progress=None, verbose=None)[source]¶

Run local-PNO CCSD(T) on the real finite-torus B Hamiltonian.

Parameters:

system (PeriodicSystem)
basis (BasisSet)
mesh (int | Sequence[int])
options (PeriodicRHFOptions | None)
cc_options (object | None)
aux_basis (str | None)
lattice_cutoff_bohr (float)
rsgdf_ke_cutoff (float)
gdf_linear_dep_threshold (float)
progress (bool | object | None)
verbose (int | None)

Return type:

AICCM2026DevBDLPNOCCSDResult