相关论文: Dynamical Jahn-Teller effect of fullerene anions

The fine structure and temperature evolution of infrared spectra have been intensively used to probe the nature of Jahn-Teller dynamics in correlated materials. At the same time, theoretical framework to adequately extract the information…

A simple model for electron-vibron interactions on charged buckminsterfullerene C$_{60}^{n-}$, $n=1,\ldots 5$, is solved both at weak and strong couplings. We consider a single $H_g$ vibrational multiplet interacting with $t_{1u}$…

In quantum dot circuits, screening electron clouds in strongly-coupled leads will hybridize with the states of the artificial atom. Using a three-terminal geometry, we directly probe the atomic structure of a quantum dot with Kondo…

We study the influence of the lattice structure, the Jahn-Teller effect and the Hund's rule coupling on a metal-insulator transition in AnC60 (A= K, Rb). The difference in lattice structure favors A3C60 (fcc) being a metal and A4C60 (bct)…

Using elastic and inelastic neutron scattering, we investigated the evolution of the local atomic structure and lattice dynamics of La(1-x)Sr(x)CoO3 (x=0-0.5) as it crosses over with x from an insulator to a ferromagnetic metal (FMM). Our…

We argue that the Jahn-Teller theorem, if applied to 3d-ion compounds, has to be considered in the orbital+spin space. It is despite of the weakness of the intraatomic spin-orbit coupling.

The properties of transition metal compounds are largely determined by nontrivial interplay of different degrees of freedom: charge, spin, lattice, but also orbital ones. Especially rich and interesting effects occur in systems with orbital…

We investigate the onset of quantum thermalization in a system governed by the Jahn-Teller Hamiltonian which describes the interaction between a single spin and two bosonic modes. We find that the Jahn-Teller model exhibits a finite-size…

A mechanism of non-magnetic Kondo effect is proposed on the basis of a multiorbital Anderson model coupled with dynamical Jahn-Teller (JT) phonons. An electron system coupled dynamically with JT phonons has a vibronic ground state with…

We study theoretically the collective E$\otimes$e Jahn-Teller-Dicke distortion in a system of trapped ions. We focus in the limit of infinite range interactions in which an ensemble of effective spins interacts with two collective…

We investigate the effect of the experimentally observed Jahn-Teller distortion of the oxygen octahedra in LaTiO3 on the magnetic exchange. We present a localized model for the effective hopping between nearest-neighbor Ti ions and the…

The infinite-$U$ Anderson model coupled to a Jahn-Teller phonon is studied using the slave boson method on the basis of the large degeneracy expansion (1/N) scheme. The model Hamiltonian acts on the orbital degrees of freedom. The main…

The electronic structure of C_(4N+2) carbon rings exhibits competing many-body effects of Huckel aromaticity, second-order Jahn-Teller and Peierls instability at large sizes. This leads to possible ground state structures with aromatic,…

We employ a combination of density functional theory and dynamical mean-field theory to investigate the electronic structure of the recently synthesized insulator BaCrO$_3$. Our calculations show that Hund's coupling is responsible for…

We investigate electron transport through a mixed-valence molecular complex in which an excess electron can tunnel between hetero-valent transition metal ions, each having a fixed localized spin. We show that in this class of molecules the…

Vibrational and magnetic properties of single-crystal uranium-thorium dioxide (UxTh1-xO2) with a full range of 0<x<1 is investigated. Thorium dioxide is a diamagnet whose thermal properties are governed by lattice vibration. The addition of…

We have analyzed different correlation functions in a realistic spin-orbital model for half-doped manganites. Using a finite-temperature diagonalization technique the CE phase was found in the charge-ordered phase in the case of small…

The Raman scattering (RS) spectra of rhombohedral $LaMnO_3$ is considered. It is shown that broad high intensity RS line at 640 $cm^{-1}$ could be explained in the framework of cooperative dynamical Jahn-Teller effect. This hypothesis is…

We use first principles density functional theory to calculate electronic and magnetic properties of TiF3 using the full potential linearized augmented plane wave method. The LDA approximation predicts a fully saturated ferromagnetic metal…

We review the recent theoretical treatment of fullerenes as pi-conjugated systems. Polaronic properties due to the Jahn-Teller type effects are mainly discussed. (1) A Su-Schrieffer-Heeger type electron-phonon model is applied to…