Search results for "CORRELATED"
showing 10 items of 1174 documents
Towards nonlocal density functionals by explicit modelling of the exchange-correlation hole in inhomogeneous systems
2013
We put forward new approach for the development of a non-local density functional by a direct modeling of the shape of exchange-correlation (xc) hole in inhomogeneous systems. The functional is aimed at giving an accurate xc-energy and an accurate corresponding xc-potential even in difficult near-degeneracy situations such as molecular bond breaking. In particular we demand that: (1) the xc hole properly contains -1 electron, (2) the xc-potential has the asymptotic -1/r behavior outside finite systems and (3) the xc-potential has the correct step structure related to the derivative discontinuities of the xc-energy functional. None of the currently existing functionals satisfies all these re…
Generation of energy selective excitations in quantum hall edge states
2011
We operate an on-demand source of single electrons in high perpendicular magnetic fields up to 30T, corresponding to a filling factor below 1/3. The device extracts and emits single charges at a tunable energy from and to a two-dimensional electron gas, brought into well defined integer and fractional quantum Hall (QH) states. It can therefore be used for sensitive electrical transport studies, e.g. of excitations and relaxation processes in QH edge states.
Orbital Rotations induced by Charges of Polarons and Defects in Doped Vanadates
2020
We explore the competiton of doped holes and defects that leads to the loss of orbital order in vanadate perovskites. In compounds such as La$_{1-{\sf x}}$Ca$_{\,\sf x}$VO$_3$ spin and orbital order result from super-exchange interactions described by an extended three-orbital degenerate Hubbard-Hund model for the vanadium $t_{2g}$ electrons. Long-range Coulomb potentials of charged Ca$^{2+}$ defects and $e$-$e$ interactions control the emergence of defect states inside the Mott gap. The quadrupolar components of the Coulomb fields of doped holes induce anisotropic orbital rotations of degenerate orbitals. These rotations modify the spin-orbital polaron clouds and compete with orbital rotat…
Magnetic and electronic properties of double perovskites and estimation of their Curie temperatures byab initiocalculations
2008
First principles electronic structure calculations have been carried out on ordered double perovskites Sr_2B'B"O_6 (for B' = Cr or Fe and B" 4d and 5d transition metal elements) with increasing number of valence electrons at the B-sites, and on Ba_2MnReO_6 as well as Ba_2FeMoO_6. The Curie temperatures are estimated ab initio from the electronic structures obtained with the local spin-density functional approximation, full-potential generalized gradient approximation and/or the LDA+U method (U - Hubbard parameter). Frozen spin-spirals are used to model the excited states needed to evaluate the spherical approximation for the Curie temperatures. In cases, where the induced moments on the oxy…
Quantum Phases and Spin Liquid Properties of 1T-TaS2
2021
Quantum materials exhibiting magnetic frustration are connected to diverse phenomena including high-Tc superconductivity, topological order and quantum spin liquids (QSLs). A QSL is a quantum phase (QP) related to a quantum-entangled fluid-like state of matter. Previous experiments on QSL candidate materials are usually interpreted in terms of a single QP, although theories indicate that many distinct QPs are closely competing in typical frustrated spin models. Here we report on combined temperature-dependent muon spin relaxation and specific heat measurements for the triangular-lattice QSL candidate material 1T-TaS2 that provide evidence for competing QPs. The measured properties are assig…
Engineering Topological Nodal Line Semimetals in Rashba Spin-Orbit Coupled Atomic Chains
2019
We study an atomic chain in the presence of modulated charge potential and modulated Rashba spin-orbit coupling (RSOC) of equal period. We show that for commensurate periodicities $\lambda=4 n$ with integer $n$, the three-dimensional synthetic space obtained by sliding the two phases of the charge potential and RSOC features a topological nodal line semimetal protected by an antiunitary particle-hole symmetry. The location and shape of the nodal lines strongly depend on the relative amplitude between the charge potential and RSOC.
Strongly interacting Fermi gases with density imbalance
2005
We consider density-imbalanced Fermi gases of atoms in the strongly interacting, i.e. unitarity, regime. The Bogoliubov-deGennes equations for a trapped superfluid are solved. They take into account the finite size of the system, as well as give rise to both phase separation and FFLO type oscillations in the order parameter. We show how radio-frequency spectroscopy reflects the phase separation, and can provide direct evidence of the FFLO-type oscillations via observing the nodes of the order parameter.
Time-dependent transport in Aharonov–Bohm interferometers
2010
A numerical approach is employed to explain transport characteristics in realistic, quantum Hall based Aharonov-Bohm interferometers. First, the spatial distribution of incompressible strips, and thus the current channels, are obtained applying a self-consistent Thomas-Fermi method to a realistic heterostructure under quantized Hall conditions. Second, the time-dependent Schr\"odinger equation is solved for electrons injected in the current channels. Distinctive Aharonov-Bohm oscillations are found as a function of the magnetic flux. The oscillation amplitude strongly depends on the mutual distance between the transport channels and on their width. At an optimal distance the amplitude and t…
Frustrated quantum spin models with cold coulomb crystals
2011
We exploit the geometry of a zig-zag cold-ion crystal in a linear trap to propose the quantum simulation of a paradigmatic model of long-ranged magnetic frustration. Such a quantum simulation would clarify the complex features of a rich phase diagram that presents ferromagnetic, dimerized antiferromagnetic, paramagnetic, and floating phases, together with previously unnoticed features that are hard to assess by numerics. We analyze in detail its experimental feasibility, and provide supporting numerical evidence on the basis of realistic parameters in current ion-trap technology.
Defects, Disorder, and Strong Electron Correlations in Orbital Degenerate, Doped Mott Insulators.
2015
We elucidate the effects of defect disorder and $e$-$e$ interaction on the spectral density of the defect states emerging in the Mott-Hubbard gap of doped transition-metal oxides, such as Y$_{1-x}$Ca$_{x}$VO$_{3}$. A soft gap of kinetic origin develops in the defect band and survives defect disorder for $e$-$e$ interaction strengths comparable to the defect potential and hopping integral values above a doping dependent threshold, otherwise only a pseudogap persists. These two regimes naturally emerge in the statistical distribution of gaps among different defect realizations, which turns out to be of Weibull type. Its shape parameter $k$ determines the exponent of the power-law dependence o…