Related papers: Elementary Building Blocks for Cluster Mott Insula…
We present results of spin-unrestricted first-principles quantum transport for a gated C$_{60}$ molecule weakly contacted to Al electrodes, making emphasis on the role played by the electronic localization and the spin degree of freedom. As…
Understanding the substructure of atomic nuclei, particularly the clustering of nucleons inside them, is essential for comprehending nuclear dynamics. Various cluster configurations can emerge depending on excitation energy, the number and…
The fate of an injected hole in a Mott antiferromagnet is an outstanding issue of strongly correlated physics. It provides important insights into doped Mott insulators closely related to high-temperature superconductivity in cuprates.…
We describe the ground- and excited-state electronic structure of bulk MnO and NiO, two prototypical correlated electron materials, using coupled cluster theory with single and double excitations (CCSD). As a corollary, this work also…
We study a class of SU(N) Heisenberg models, describing Mott insulators of fermionic ultra-cold alkaline earth atoms on the three-dimensional simple cubic lattice. Based on an earlier semiclassical analysis, magnetic order is unlikely, and…
We present a class of holographic models that behave effectively as prototypes of Mott insulators, materials where electron-electron interactions dominate transport phenomena. The main ingredient in the gravity dual is that the gauge-field…
We expand on our earlier work (cond-mat/0612130, Phys. Rev. Lett. {\bf 99}, 46404 (2007)) in which we constructed the exact low-energy theory of a doped Mott insulator by explicitly integrating (rather than projecting) out the degrees of…
At the Mott transition, electron-electron interaction changes a metal, in which electrons are itinerant, to an insulator, in which electrons are localized. This phenomenon is central to quantum materials. Here we contribute to its…
Molecular fragment or embedding methods are powerful techniques for overcoming scalability limitations in electronic structure theory by dividing large molecular systems into individual units that are small enough to be treated using…
We investigate the behaviour of a system of particles with the different character of interaction. The approach makes it possible to describe systems of interacting particles by statistical methods taking into account a spatial…
We study the development of electron-electron correlations in circular quantum dots as the density is decreased. We consider a wide range of both electron number, N<=20, and electron gas parameter, r_s<18, using the diffusion quantum Monte…
We investigate the ground state properties of an ultracold atom system consisting of many-body polarons, quasiparticles formed by impurity atoms in optical lattices immersing in a Bose-Einstein condensate. We find the nearest-neighbor…
Correlated materials are known to display qualitatively distinct emergent behaviors at low energy. Conveniently, upon absorbing rapid quantum fluctuations, these rich low-energy behaviors can always be effectively described by dressed…
Superconducting circuits are a competitive platform for quantum computation because they offer controllability, long coherence times and strong interactions - properties that are essential for the study of quantum materials comprising…
Topological insulators are unique physical structures that are insulators in their bulk, but support currents at their edges which can be unidirectional and topologically protected from scattering on disorder and inhomogeneities. Photonic…
We study the particle-hole symmetry in the Hubbard model using ultracold fermionic atoms in an optical lattice. We demonstrate the mapping between charge and spin degrees of freedom and, in particular, show the occurrence of a state with…
Quantitative analysis of quantum many-body systems, consisting of numerous itinerant electrons that interact with localized spins or electrons, is a long-standing issue. The Kondo cloud, a quantum many-body object of conduction electrons…
Recently, some of the authors introduced the use of the Householder transformation as a simple and intuitive method for the embedding of local molecular fragments (see Sekaran et. al., Phys. Rev. B 104, 035121 (2021), and Sekaran et. al.,…
On the basis of the multi-orbital dynamical mean field theory, a three-orbital Hubbard model with a relativistic spin-orbit coupling (SOC) is studied at five electrons per site. The numerical calculations are performed by employing the…
Although the mechanism of superconductivity in the cuprates remains elusive, it is generally agreed that at the heart of the problem is the physics of doped Mott insulators. The cuprate parent compound has one unpaired electron per Cu site,…