ffsim.spinful_to_spinless_rdm2

ffsim.spinful_to_spinless_rdm2(mat_aa, mat_ab, mat_bb)[source]

Convert a spinful 2-RDM to a spinless 2-RDM.

Parameters:
  • mat_aa (ndarray) – The alpha-alpha part of the 2-RDM.

  • mat_ab (ndarray) – The alpha-beta part of the 2-RDM.

  • mat_bb (ndarray) – The beta-beta part of the 2-RDM.

Return type:

ndarray

Returns:

The 2-RDM as a single tensor in spinless format.