Related papers: Inhomogeneous Electronic Distribution in High-Tc C…
We use unrestricted Hartree-Fock, density matrix renormalization group, and variational projected entangled pair state calculations to investigate the ground state phase diagram of the triangular lattice Hubbard model at "half doping"…
The electronic momentum distribution ${\rm n({\bf k})}$ of the two dimensional Hubbard model is studied for different values of the coupling ${\rm U/t}$, electronic density ${\rm \langle n \rangle}$, and temperature, using quantum Monte…
The distribution of electrons and holes in the CuO$_2$ plane of the high-temperature superconducting cuprates is determined with nuclear magnetic resonance through the quadrupole splittings of $^{17}$O and $^{63}$Cu. Based on new data for…
A central question in the high temperature cuprate superconductors is the fate of the parent Mott insulator upon charge doping. Here we use scanning tunneling microscopy to investigate the local electronic structure of lightly doped cuprate…
We study the doping-driven Mott metal-insulator transition for multi-orbital Hubbard models with Hund's exchange coupling at finite temperatures. As in the single-orbital Hubbard model, the transition is of first-order within dynamical mean…
We investigate the phase diagram of the electron-doped systems in high-Tc cuprates. We calculate the superconducting transition temperature Tc, the antiferromagnetic transition temperature TN, the NMR relaxation rate 1/T1 with the…
The Hartree-Fock ground-state phase diagram of the one-dimensional Hubbard model is calculated in the $\mu-U$ plane, restricted to phases with no charge density modulation, extending the results presented in cond-mat/9511116. This allows…
We study the boundary physics of bulk insulators by considering three coupled Hubbard chains in a linear confining potential. In the Hartree-Fock approximation, the ground state at and slightly off the particle-hole symmetric point remains…
Recent scanning tunneling microscopy measurements on cuprate superconductors have revealed remarkable spatial inhomogeneities in the single-particle energy gap. Using cellular dynamical mean-field theory, we study the zero temperature…
We present a numerical study of the doping dependence of the spectral function of the n-type cuprates. Using a variational cluster-perturbation theory approach based upon the self-energy-functional theory, the spectral function of the…
We use scanning tunneling microscopy to visualize the atomic-scale electronic states induced by a pair of hole dopants in Ca2CuO2Cl2 parent Mott insulator of cuprates. We find that when the two dopants approach each other, the transfer of…
On the basis of Quantum-Monte-Carlo results the evolution of the spectral weight $A(\vec k, \omega)$ of the two-dimensional Hubbard model is studied from insulating to metallic behavior. As observed in recent photoemission experiments for…
Spin-state transitions, observed in many transition metal compounds containing Co$^{3+}$ and Fe$^{2+}$, may occur with the change of temperature, pressure, but also with doping, in which case the competition of single-site effects and…
The three-band Hubbard model is a fundamental model for understanding properties of the Copper-Oxygen planes in cuprate superconductors. We use cutting-edge auxiliary-field quantum Monte Carlo (AFQMC) methods to investigate ground state…
The evolution of the electronic structures of strongly correlated insulators with doping has long been a central fundamental question in condensed matter physics; it is also of great practical relevance for applications. We have studied the…
Motivated by the highest superconducting transition temperature ($T_c$) in multilayer cuprates,we investigated the trilayer Hubbard model by adopting the large-scale dynamical cluster quantum Monte Carlo simulations. Focusing on the systems…
A new theoretical model is presented to study the nanoscale electronic inhomogeneity in high-$T_c$ cuprates. In this model, we argue that the randomly distributed out-of-plane interstitial oxygen dopants induces locally the off-diagonal…
The electronic and optical properties of the paradigmatic F4TCNQ-doped pentacene in the low-doping limit are investigated by a combination of state-of-the-art many-body \emph{ab initio} methods accounting for environmental screening…
In strongly correlated transition metal dichalcogenides, an intricate interplay of polaronic distortions, stacking arrangement, and electronic correlations determines the nature of the insulating state. Here, we study the response of the…
High-temperature superconductivity (HTSC) mysteriously emerges upon doping holes or electrons into insulating copper oxides with antiferromagnetic (AFM) order. It has been thought that the large energy scale of magnetic excitations,…