The variational reduced density matrix theory has been recently applied with great success to models within the truncated doubly occupied configuration interaction space, which corresponds to the seniority zero subspace. Conservation of the seniority quantum number restricts the Hamiltonians to be based on the SU(2) algebra. Among them there is a whole family of exactly solvable Richardson-Gaudin pairing Hamiltonians. We benchmark the variational theory against two different exactly solvable models, the Richardson-Gaudin-Kitaev and the reduced BCS Hamiltonians. We obtain exact numerical results for the so-called [Formula: see text] N-representability conditions in both cases for systems that go from 10 to 100 particles. However, when random single-particle energies as appropriate for small superconducting grains are considered, the exactness is lost but still a high accuracy is obtained.
Articles you may be interested in Direct variational determination of the two-electron reduced density matrix for doubly occupied-configurationinteraction wave functions: The influence of three-index N-representability conditions
This work deals with the variational determination of the two-particle reduced density matrix (2-RDM) and the energy corresponding to the ground state of N-particle systems within the doubly occupied configuration interaction (DOCI) space. Here, we impose for the first time up to four-particle N-representability constraint conditions in the variational determination of the 2-RDM matrix elements using the standard semidefinite programming algorithms. The energies and 2-RDMs obtained from this treatment and the corresponding computational costs are compared with those arisen from previously reported less restrictive variational methods [D. R. Alcoba et al., J. Chem. Phys. 149, 194105 (2018)] as well as with the exact DOCI values. We apply the different approximations to the one-dimensional XXZ model of quantum magnetism, which has a rich phase diagram with one critical phase and constitutes a stringent test for the method. The numerical results show the usefulness of our treatment to achieve a high degree of accuracy.
This work incorporates translational and reflection symmetry reductions to the variational determination of the two-particle reduced density matrix (2-RDM) corresponding to the ground state of N-particle systems, within the doubly occupied configuration interaction (DOCI) space. By exploiting these symmetries within this lower-bound variational methodology it is possible to treat larger systems than those previously studied. The 2-RDM matrix elements are calculated by imposing up to four-particle N-representability constraint conditions using standard semidefinite programing algorithms. The method is applied to the one- and two-dimensional XXZ spin 1/2 model of quantum magnetism. Several observables including the energy and the spin–spin correlation functions are obtained to assess the physical content of the variationally determined 2-RDM. Comparison with quantum-Monte Carlo and matrix product state simulations shows that in most cases only requiring up to three-particle positivity conditions is enough to correctly describe the ground-state properties of these one- and two-dimensional models.
We derive the exact solution of a system of N -level atoms in contact with a Markovian reservoir. The resulting Liouvillian expressed in a vectorized basis is mapped to an SU (N ) trigonometric Richardson-Gaudin model whose exact solution for the complete set of eigenmodes is given by a set of non-linear coupled equations. For N = 2 (SU (2)) we recover the exact solution of Phys. Rev. Lett. 122, 010401 (2019). We then study the SU (3) case for three-level atom systems and discuss the properties of the steady state and dissipative gaps for finite systems as well as for the thermodynamic limit.
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