Reduced density matrices for fermi superfluid systems

P. Lal, Ch. Terreaux

К. С. Матвийчук

Rashmiraj Balkrishna Prabhu

В. А. Головко

The hierarchy of equations for reduced density matrices relevant to thermodynamic equilibrium with account taken of the spin obtained earlier is modified in order to describe the state of a Fermi system with a condensate. Although the procedure is to some extent analogous with the one carried out by the author earlier for a Bose liquid peculiarities relevant to Fermi statistics complicate considerably the treatment. As in the case of the Bose liquid the condensate phase can be superfluid as well as nonsuperfluid, the physical causes of superfluidity being identical. A new mechanism of fermion pairing that acts even in the case of a purely repulsive Hamiltonian is pointed out. Special attention is given to the thermodynamics of a superfluid Fermi system. The example of a hard-sphere system is used to find out the form of phase diagrams, the character of the phase transition to a condensate phase and the properties of the last. Noticeable dissimilarities from a Bose system with the same Hamiltonian are revealed. Application of the present approach to superconductivity is discussed as well.

Victor Nikolaevich Popov, Vladimir Sergeevich Yarunin

Gustavo E. Massaccesi, Ofelia B. Oña, Luis Lain +4 more

Reduced density matrices are central to describing observables in many-body quantum systems. In electronic structure theory, the two-particle reduced density matrix (2-RDM) suffices to determine the energy and other key properties. Recent work has used matrix completion, leveraging the low-rank structure of RDMs and approximate theoretical models, to reconstruct the 2-RDM from partial data and thus reduce computational cost. However, matrix completion is, in general, an under-determined problem. Revisiting Rosina's theorem [M. Rosina, Queen's Papers on Pure and Applied Mathematics No. 11, 369 (1968)], we here show that the matrix completion is unique under certain conditions, identifying the subset of 2-RDM elements that enables its exact reconstruction from incomplete information. Building on this, we introduce a hybrid quantum-stochastic algorithm that achieves exact matrix completion, demonstrated through applications to the Fermi-Hubbard model.