“W = 0” pairing in Cu-O clusters and in the plane

The Cu-O plane and the clusters that possess the same C_4v symmetry around a Cu ion have 2-hole eigenstates of the kinetic energy with vanishing on-site repulsion (W=0 pairs). Cluster calculations by exact diagonalisation show that these are the quasiparticles that lead to a paired ground state, and have superconducting flux-quantisation properties. Here, we extend the theory to the full plane, and show that the W=0 quasiparticles are again the natural explanation of superconducting flux-quantisation. Moreover, by a new approach which is exact in principle, we calculate the effective interaction between two holes added to the ground state of the repulsive three-band Hubbard model. To explain how a noninteracting electron gas becomes a superconductor when switching the local Coulomb interaction, we obtain a closed-form analytic expression including the effects of all virtual transitions to 4-body intermediate states (exchange of an electron-hole pair). Our scheme is ready to include other interactions which are not considered in the Hubbard model but may be important. In the plane, the W=0 pairs have ¹ B ₂ and ¹ A ₂ symmetry. The effective interaction in these channels is attractive and leads to a Cooper-like instability of the Fermi liquid, while it is repulsive for triplet pairs. From , we derive an integral equation for the pair eigenfunction; the binding energy of the pairs is in the range of tens of meV. However, our symmetry-based method is far more general than the model. Received 18 December 1998     

Correlation-induced memory effects in transport properties of low-dimensional systems

We demonstrate the remnant presence of initial correlations in the steady-state electrical current jS flowing between low-dimensional interacting leads. The leads are described as Luttinger liquids and electrons can tunnel via a quantum point contact. We derive an analytic result for the time-dependent current and show that ground-state correlations have a large impact on the relaxation and long-time behavior. In particular, the I-V characteristic is not reproduced by quenching the interaction in time. We further present a universal formula of jS for an arbitrary sequence of interaction quenches and it is established that jS is history dependent for nonsmooth switching process.     

On-site repulsion as the source of pairing in carbon nanotubes and intercalated graphite

We show that different non-conventional superconductors have one fundamental feature in common: pair eigenstates of the Hamiltonian are repulsion-free, the W = 0 pairs. In extended Hubbard models, pairing can occur for reasonable parameter values. For (N, N) nanotubes the binding energy of the pair depends strongly on the filling and decreases towards a reduced but nonzero value for the graphite sheet N → ∞. Received 13 July 2002 Published online 29 November 2002     

Pairing in the Hubbard model: the Cu O cluster versus the Cu-O plane

We study the Cu₅O₄ cluster by exact diagonalization of a three-band Hubbard model and show that bound electron or hole pairs are obtained at appropriate fillings, and produce superconducting flux quantization. The results extend earlier cluster studies and illustrate a canonical transformation approach to pairing that we have developed recently for the full plane. The quasiparticles that in the many-body problem behave like Cooper pairs are W =0 pairs, that is, two-hole eigenstates of the Hubbard Hamiltonian with vanishing on-site repulsion. The cluster allows W =0 pairs of d symmetry, due to a spin fluctuation, and ssymmetry, due to a charge fluctuation. Flux quantization is shown to be a manifestation of symmetry properties that hold for clusters of arbitrary size. Received 23 July 1999     

Classical nuclear motion in quantum transport

An ab initio quantum-classical mixed scheme for the time evolution of electrode-device-electrode systems is introduced to study nuclear dynamics in quantum transport. Two model systems are discussed to illustrate the method. Our results provide the first example of current-induced molecular desorption as obtained from a full time-dependent approach and suggest the use of ac biases as a way to tailor electromigration. They also show the importance of nonadiabatic effects for ultrafast phenomena in nanodevices.