Related papers: An efficient implementation of high-order coupled-…
We investigate the coupling of different quantum-embedding approaches with a third molecular-mechanics layer, which can be either polarizable or non-polarizable. In particular, such a coupling is discussed for the multilevel families of…
For a class of quasi-one-dimensional clusters, by using exact diagonalization, we study the effect of side spins on the spin-spin correlations on chain. Our calculations show that the side spins added in the same sublattice can effectively…
We present new results for the Kondo lattice model of strongly correlated electrons, in 1-, 2-, and 3-dimensions, obtained from high-order linked-cluster series expansions. Results are given for varies ground state properties at…
Quantum Monte Carlo method is used to study the coupled spin-pseudospin Hamiltonian in one-dimension (1D) that models the charge-ordering instability of the anisotropic Hubbard ladder at quarter filling. We calculate the temperature…
The experimental realization of various spin ladder systems has prompted their detailed theoretical investigations. Here we study the evolution of ground state magnetization with an external magnetic field for two different…
The cluster state represents a highly entangled state which is one central object for measurement-based quantum computing. Here we study the robustness of the cluster state on the two-dimensional square lattice at zero temperature in the…
In the molecular quantum chemistry community, coupled-cluster (CC) methods are well-recognized for their systematic convergence and reliability. The extension of the theory to extended systems has been comparably recent, so that…
The variational quantum eigensolver has been proposed as a low-depth quantum circuit that can be employed to examine strongly correlated systems on today's noisy intermediate-scale quantum computers. We examine details associated with the…
Quantum Monte Carlo (QMC) simulations constitute nowadays one of the most powerful methods to study strongly correlated quantum systems, provided that no "sign problem" arises. However, many systems of interest, including highly frustrated…
In Coupled-Cluster (CC) theory, unphysical complex energies may arise in the presence of strong magnetic fields, near conical intersections, or in systems exhibiting complex Abelian point group symmetries. This issue originates from the…
The power of machine learning algorithms to automatically classify different phases of matter and detect quantum phase transitions without necessity to characterize phases by various quantities like local order parameters or topological…
The variational quantum eigensolver is one of the most promising algorithms for near-term quantum computers. It has the potential to solve quantum chemistry problems involving strongly correlated electrons, which are otherwise difficult to…
In this article, the correlated basis-function (CBF) method is applied for the first time to the quantum spin-half {\it XY} model on the linear chain, the square lattice, and the simple cubic lattice. In this treatment of the quantum…
Coupled cluster theory is the method of choice for weakly correlated systems. But in the strongly correlated regime, it faces a symmetry dilemma, where it either completely fails to describe the system, or has to artificially break certain…
The effective lattice models in strongly correlated electron systems are \emph{derived} in particular for the cuprate superconductors, that incorporate the quantum fluctuations of the spin Berry's phase and the antiferromagnetic…
We study the low-lying energy clustering patterns of quantum antiferromagnets with p sublattices (in particular p=4). We treat each sublattice as a large spin, and using second-order degenerate perturbation theory, we derive the effective…
The coupled cluster or exp S form of the eigenvalue problem for lattice Hamiltonian QCD (without quarks) is investigated. A new construction prescription is given for the calculation of the relevant coupled cluster matrix elements with…
The practical application of quantum technologies to chemical problems faces significant challenges, particularly in the treatment of realistic basis sets and the accurate inclusion of electron correlation effects. A direct approach to…
While the diagonalization of a quadratic bosonic form can always be done using a Bogoliubov transformation, the practical implementation for systems with a large number of different bosons is a tedious analytical task. Here we use the…
The phase transition of a random mixed-bond Ising ferromagnet on a cubic lattice model is studied both numerically and analytically. In this work, we use the Cluster algorithms of Wolff and Glauber to simulate the dynamics of the system. We…